(Z)-3-hexen-1-yl (Z)-3-hexenoate
  • Apiscent Labs
    • Apiscent Labs, LLC
      Delivery of Quality
      Custom manufacturer and international supplier of fine ingredients.
      We believe inspired chemistry enriches lives. That's why our team is guided by a mission to provide fine ingredients to the worldwide pharmaceutical, flavor and fragrance markets with a primary focus on the manufacturing of value-added, research-based molecules. We're innovative problem solvers committed to excellence at every phase. Our work builds the foundation for our clients' continued success.
      Email: Info
      Email: Carl Sheeley
      Email: Customer Service
      Voice: +1 (414) 744 3993
      Fax: +1 (414) 744 7111
      Product(s):
      C3 HEXENYL C3 HEXENOATE
       
  • Bedoukian Research
    • Bedoukian Research, Inc.
      Constantly Improving
      Working closely with our customers to meet their requirements.
      Paul Bedoukian founded the company to fill a niche as a supplier of high quality specialty aroma and flavor ingredients. In 1975 the company began manufacturing insect pheromones which are chemically similar to flavor and fragrance ingredients. Today, Bedoukian Research offers more than 450 Aroma Chemicals and 50 Insect Pheromones, while also providing custom manufacturing services to the pharmaceutical, agrochemical, and specialty chemical industries.
      US Email: Customer Service
      US Voice: 1-203-830-4000
      US Fax: 1-203-830-4010
      Products List: View
      Product(s):
      121 cis-3-HEXENYL CIS-3-HEXENOATE ≥96.0% (cis,cis), Kosher
      MSDS
      Can be used for 'natural' topnotes in fragrance compositions.
      Can be used in watermelon, pear, vegetable, peach, olive and apple flavors. Can also be used for its 'natural' note.
       
      121NAT cis-3-HEXENYL CIS-3-HEXENOATE (NATURAL) ≥96.0% (cis,cis), Kosher
      MSDS
       
  • Firmenich
    • Firmenich Inc.
      We Create
      We create perfumes and flavors for the World's most desirable brands.
      Firmenich is the largest privately-owned company in the perfume and flavor business. Swiss and family owned, we have created many of the world’s favorite perfumes for over 100 years and produced a number of the most well known flavors we enjoy each day.
      US Email: Fred Keifer
      US Voice: +1 609 452 1000
      US Fax: +1 609 452 6077
      Product(s):
      992510 Williams Ester
      Excellent as a more longer lasting fruity pear version of Cis-Hexenol Ester.
       
       
  • Lluch Essence
    • Lluch Essence S.L.
      A family company dedicated to sales and distribution
      Flexibility, availability, price and quality.
      Flexibility, availability, price and quality make LLUCH ESSENCE S.L. one of Europe’s references when it comes to essential oils and aroma chemicals, and it is now well known all around the world.
      Email: Info
      Voice: 34 93 379 38 49
      Fax: 34 93 370 65 04
      Product(s):
      cis-3-HEXENYL CIS-3-HEXENOATE 95%
       
  • Penta International
  • SAFC Global
    • SAFC
      Complete Supply Chain
      The perfect blend of products and services that bring your creativity to life.
      Sigma-Aldrich is a leading Life Science and High Technology company dedicated to providing high-quality, safe and certified flavor ingredients with transparent and easily accessible documentation to customers around the globe. Sigma-Aldrich also provides a suite of analytical tools that allow food analysts to simplify sample preparation, cleanup and analysis steps, while increasing sensitivity to trace ingredients and harmful substances to meet regulations and quality standards.
      Email: Information
      US Email: Sales
      US Voice: 800-244-1173
      US Fax: 800-368-4661
      Product(s):
      W368903 cis-3-Hexenyl cis-3-hexenoate ≥94%, Kosher
      MSDS
       
 
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Fragrance Demo Formulas
[(Z)-hex-3-enyl] (Z)-hex-3-enoate (Click)
CAS Number: 61444-38-0
% from: 96.00% to 99.90%
ECHA EC Number: 262-797-3
FDA UNII: KNS0IV43AT
MDL: MFCD00036652
FEMA Number: 3689
XlogP3-AA: 3.30 (est)
Molecular Weight: 196.28980000
Formula: C12 H20 O2
NMR Predictor: Predict
EFSA/JECFA Comments: JECFA evaluated cis-3-hexenyl cis-3-hexenoate (CASrn as in Register). CASrn in Register refers to the (Z)/(Z)-isomer. Register name to be changed to Hex-3Z-enyl hex-3Z-enoate.
Category: flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist: Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
JECFA Food Flavoring: 336  cis-3-hexenyl cis-3-hexenoate
Flavis Number: 09.291 (Old)
EU SANCO Food Flavourings: 09.291  hex-3Z-enyl hex-3Z-enoate

FEMA Number: 3689  cis-3-hexenyl cis-3-hexenoate
FDA Mainterm: CIS-3-HEXENYL CIS-3-HEXENOATE
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.86500 to 0.90200 @  25.00 °C.
Pounds per Gallon - (est).: 7.198 to  7.506
Refractive Index: 1.44700 to 1.45500 @  20.00 °C.
Boiling Point: 60.00 °C. @ 0.50 mm Hg
Boiling Point: 112.00 °C. @ 12.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.012200 mm/Hg @ 25.00 °C. (est)
Vapor Density: >1 ( Air = 1 )
Flash Point: 210.00 °F. TCC ( 98.89 °C. )
logP (o/w): 4.298 (est)
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Organoleptic Properties:
Odor Type: green
Odor Strength: medium
Odor Description:
at 100.00 %. 
green tomato leaf pear melon metallic fennel tropical
Luebke, William tgsc, (2009)
Odor sample from: Bedoukian Research, Inc.
Taste Description:
green metallic green tomato
Substantivity: 13 hour(s) at 100.00 %
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Apiscent Labs
C3 HEXENYL C3 HEXENOATE
Odor: Green tomato leaf
Apple Flavor & Fragrance
cis-3-Hexenyl cis-3-hexenoate
Bedoukian Research
cis-3-HEXENYL CIS-3-HEXENOATE (NATURAL)
≥96.0% (cis,cis), Kosher
Odor: Fresh, ethereal, meaty part of the pear, green, fruity
Bedoukian Research
cis-3-HEXENYL CIS-3-HEXENOATE
≥96.0% (cis,cis), Kosher
Odor: A pear, melon, vegetable-like odor with natural connotations
Use: Can be used for 'natural' topnotes in fragrance compositions.
Flavor: green
Can be used in watermelon, pear, vegetable, peach, olive and apple flavors. Can also be used for its 'natural' note.
CG Herbals
cis-3-Hexenyl Cis-3-hexenoate
Firmenich
Williams Ester
Odor: Fruity green note similar to a fresh Williams pear
Use: Excellent as a more longer lasting fruity pear version of Cis-Hexenol Ester.
Lluch Essence
cis-3-HEXENYL CIS-3-HEXENOATE 95%
Odor: TOMATO LEAF
Moellhausen
Cis-3-HEXENYL CIS-3-HEXENOATE
Nature-identical
Odor: very natural, green-fruity; pear- and melon-like
Penta International
cis-3-HEXENYL cis-3-HEXENOATE NATURAL, Kosher
Penta International
cis-3-HEXENYL cis-3-HEXENOATE, Kosher
SAFC Global
cis-3-Hexenyl cis-3-hexenoate
≥94%, Kosher
Odor: melon
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Safety Information:
European information :
Most important hazard(s):
None - None found.
  S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
  Not determined
Dermal Toxicity:
  Not determined
Inhalation Toxicity:
  Not determined
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Safety in Use Information:
Category: flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU): 3.20 (μg/capita/day)
Recommendation for (Z)-3-hexen-1-yl (Z)-3-hexenoate usage levels up to:
  12.0000 % in the fragrance concentrate.
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Safety References:
European Food Safety Athority(efsa): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 6 (FGE.06): Straight-and branched-chain aliphatic unsatured primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4
page or pdf
Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to Flavouring Group Evaluation 5: Esters of 23 branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and 24 branched- and straight-chain unsaturated carboxylic acids from chemical groups 1, 2, and 5
page or pdf
Flavouring Group Evaluation 6, Revision 1 (FGE.06Rev1) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
page or pdf
Flavouring Group Evaluation 5, Revision 1 (FGE.05Rev1):Esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids from chemical groups 1, 2, and 5 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
page or pdf
Flavouring Group Evaluation 5, Revision 2 (FGE.05Rev2): Branched- and straight-chain unsaturated carboxylic acids and esters of these with aliphatic saturated alcohols from chemical groups 1, 2, 3 and 5
page or pdf
EPI System: View
Chemicalize.org: Calculate predicted properties
EPA Substance Registry Services (TSCA): 61444-38-0
EPA ACToR: Toxicology Data
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 [(Z)-hex-3-enyl] (Z)-hex-3-enoate
Chemidplus: 0061444380
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References:
 [(Z)-hex-3-enyl] (Z)-hex-3-enoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 61444-38-0
Pubchem (cid): 6435882
Pubchem (sid): 135020950
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS): View
Export Tariff Code: 2916.19.6000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 acetaldehyde methyl hexyl acetalFR
isoamyl butyrateFL/FR
 amyl hexanoateFL/FR
 apple crotonateFR
 butyl isobutyrateFL/FR
 butyl isovalerateFL/FR
trans-carveolFL/FR
laevo-carveolFL/FR
laevo-carvoneFL/FR
cis-carvone-5,6-oxideFL/FR
 carvyl acetateFL/FR
 cinnamyl isovalerateFL/FR
 costus root absoluteFL
 costus root oilFL
 costus root resinoidFL
(E,E)-2,4-decadienalFL
2,4-decadien-1-olFL/FR
 diethyl sebacateFL/FR
 dihydrocarveolFL/FR
dextro-dihydrocarvoneFL/FR
 dill seed oil indianFL/FR
2,4-dimethyl-3-cyclohexene-1-methanyl acetateFR
(E,Z)-2,6-dodecadienalFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 ethyl (E)-2-decenoateFL/FR
 ethyl (E)-4-octenoateFR
 ethyl (Z)-3-hexenoateFL/FR
 ethyl 2-cyclohexyl propionateFR
 ethyl cyclohexane propionateFL/FR
 ethyl octanoateFL/FR
 green heptenalFR
(Z)-3-hepten-1-olFL/FR
 heptyl acetateFL/FR
 hexanal diethyl acetalFL/FR
3-hexenalFL/FR
(E)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
2-hexenyl cyclopentanyl acetateFR
(Z)-3-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
(E)-2-hexen-1-yl isovalerateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl pyruvateFL/FR
(Z)-3-hexen-1-yl valerateFL/FR
 hexyl (E)-tiglateFL/FR
 hexyl 2-furoateFL/FR
 hexyl 2-methyl-3-pentenoateFL/FR
 hexyl isobutyrateFL/FR
 hexyl propionateFL/FR
2'-hydroxyacetophenoneFL/FR
(Z)-leaf acetalFL/FR
 linalyl hexanoateFL/FR
 melon acetalFL/FR
 melon carboxaldehydeFR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 manzanateFL/FR
cis+trans-para-1(7)8-menthadien-2-yl acetateFL
3-mercaptohexyl acetateFL/FR
 methoxycitronellalFR
 methoxymelonalFL/FR
 methyl (E)-2-octenoateFL/FR
 methyl (E)-3-nonenoateFL
 methyl 2-octenoateFL/FR
 methyl (E,Z)-2,4-decadienoateFL/FR
 methyl 3-nonenoateFL/FR
 methyl nonanoateFL/FR
 methyl octine carbonateFL/FR
para-methyl phenoxyacetaldehydeFR
1-methyl thio-2-propanoneFL
 mint lactoneFL/FR
 muguet carbaldehydeFR
 musk propanoateFR
 nerolidyl isobutyrateFR
(E,E)-2,6-nonadienalFL
(E,Z)-3,6-nonadien-1-olFL/FR
(Z,Z)-3,6-nonadien-1-olFL/FR
2,4-nonadien-1-olFL/FR
3,6-nonadien-1-olFL/FR
(E,Z)-3,6-nonadien-1-yl acetateFL/FR
3,6-nonadien-1-yl acetateFL/FR
(Z)-6-nonenalFL/FR
(E)-2-nonen-1-olFL/FR
(Z)-2-nonen-1-olFL/FR
(Z)-3-nonen-1-olFL/FR
(Z)-6-nonen-1-olFL/FR
(Z)-6-nonen-1-yl acetateFL/FR
2-nonyn-1-al dimethyl acetalFR
(E,E)-2,4-octadienalFL
2,4-octadienalFL
3-octanolFL/FR
(Z)-3-octen-1-olFL/FR
(Z)-5-octen-1-olFL/FR
(Z)-3-octen-1-yl propionateFL/FR
(Z)-5-octen-1-yl propionateFL/FR
3-octen-2-olFL/FR
 pear valerateFR
 propyl 2,4-decadienoateFL/FR
 propyl acetateFL/FR
 propyl heptanoateFL/FR
 propyl isobutyrateFL/FR
isopropyl isobutyrateFL/FR
 propyl nonanoateFL/FR
 sorbyl isobutyrateFL/FR
 spearmint absoluteFL/FR
 spearmint oil americaFL/FR
 spearmint oil terpenelessFL/FR
 tetrahydrocarvoneFL/FR
(E)-2-tridecen-1-yl acetateFL/FR
 tropical indeneFR
 violet dienyneFR
 violet nitrileFR
 watermelon ketoneFR
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Potential Uses:
 appleFR
 fruitFR
 greenFR
 kiwiFR
 mangoFR
 melon watermelon muskmelon cantaloupe 
 natural 
 pearFR
 strawberryFR
 tobaccoFR
 tomatoFL
 violetFR
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Natural Occurrence in: note
 gardenia absolute
GRIN Trop Picture
 tea black tea
 tea green tea
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Synonyms:
(3Z)-hex-3-en-1-yl (3Z)-hex-3-enoate
(Z)-hex-3-enyl (Z)-hex-3-enoate
cis-hex-3-enyl cis-hex-3-enoate
[(Z)-hex-3-enyl] (Z)-hex-3-enoate
 hex-3Z-enyl hex-3Z-enoate
(Z)-3-hexen-1-yl (Z)-3-hexenoate
cis-3-hexen-1-yl cis-3-hexenoate
(3Z)-3-hexenoic acid (3Z)-3-hexenyl ester
(Z,Z)-3-hexenoic acid 3-hexenyl ester
3-hexenoic acid, (3Z)-3-hexen-1-yl ester, (3Z)-
3-hexenoic acid, (3Z)-3-hexenyl ester, (3Z)-
3-hexenoic acid, 3-hexenyl ester, (Z,Z)-
(Z)-3-hexenyl (Z)-3-hexenoate
3-hexenyl (Z)-3-hexenoate, (Z)-
C3 hexenyl C3 hexenoate
cis-3-hexenyl cis-3-hexenoate
cis-3-hexenyl cis-3-hexenoate (natural)
cis-3-hexenyl cis-3-hexenoate natural
3-hexenyl cis-3-hexenoate, cis-
 williams ester
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Synonyms   Articles   Notes   Search   Top
click on the picture(s) below to
interact with the 3D model
Picture of molecule
Soluble in:
 alcohol
 water, 8.588 mg/L @ 25 °C (est)
Insoluble in:
 water
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