acetyl butyryl
  • Vigon International
    • Vigon International, Inc.
      The Yipppeee! Team
      Manufacturer and supplier of high quality flavor and fragrance ingredients.
      The growth and success of Vigon is due in large part to a unique corporate concept that Vigon has developed and established within the industry: Creative Partnerships. This partnership concept has been and continues to be the foundation and guiding principle for all of Vigon's activities.
      US Email:Sales
      US Voice:570-476-6300
      US Fax:570-476-1110
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      Product(s):
      500535 Acetyl Butyryl (2,3-Hexanedione)
      MSDS
       
 
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hexane-2,3-dione (Click)
CAS Number: 3848-24-6
ECHA EC Number:223-350-8
FDA UNII:559ANR3NVS
Beilstein Number:1699896
MDL:MFCD00009398
FEMA Number:2558
CoE Number:152
XlogP3-AA:0.40 (est)
Molecular Weight:114.14410000
Formula:C6 H10 O2
NMR Predictor:Predict
EFSA/JECFA Comments:At least 93%; secondary components 2-3% hexanediones. (JECFA)
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
IBM Patents: Obtain
Pubchem Patents:Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring:412  2,3-hexanedione
Flavis Number:07.018 (Old)
EU SANCO Food Flavourings:07.018  hexane-2,3-dione

FEMA Number:2558  2,3-hexanedione
FDA Mainterm: 2,3-HEXANEDIONE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
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Physical Properties:
Appearance:yellow clear liquid (est)
Assay: 96.00 to 100.00 % 
Food Chemicals Codex Listed:No
Specific Gravity:0.93400 @  25.00 °C.
Refractive Index:1.41300 @  20.00 °C.
Melting Point: -30.00 °C. @ 760.00 mm Hg
Boiling Point: 128.00 °C. @ 760.00 mm Hg
Vapor Pressure:10.000000 mm/Hg @ 20.00 °C.
Vapor Density:3.9 ( Air = 1 )
Flash Point: 83.00 °F. TCC ( 28.33 °C. )
logP (o/w): -0.321 (est)
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Organoleptic Properties:
Odor Type:buttery
Odor Strength:high ,
recommend smelling in a 1.00 % solution or less
Odor Description:
at 1.00 % in dipropylene glycol. 
dry sweet caramel butter oily fatty creamy phenolic fruity
Luebke, William tgsc, (1988)
Odor sample from:Fritzsche Dodge & Olcott, Inc.
Odor Description:
Sweet, creamy, caramellic, buttery with a fruity jammy nuance
Mosciano, Gerard P&F 16, No. 6, 43, (1991)
Taste Description:
at 50.00 ppm.  
Creamy, fruity, toasted brown caramellic notes
Mosciano, Gerard P&F 16, No. 6, 43, (1991)
Substantivity:220 hour(s) at 100.00 %
  
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Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Anhui Haibei
Acetyl Butyryl
Odor: Dry sweet butter oily creamy fatty fruity jam
CTC Organics
acetyl butyryl
Ernesto Ventós
2,3-HEXANEDIONE
Odor: CREAMY, SWEET, BUTTERY, CHEESY
Frutarom
acetyl butyryl
Frutarom
acetyl butyryl
Indukern F&F
ACETYL BUTYRYL
Odor: SWEET, CREAMY, BUTTER
Inoue Perfumery
ACETYL BUTYRYL
Lluch Essence
ACETYL BUTIRYL
Odor: CREAMY, SWEET, BUTTERY
Pearlchem Corporation
Acetyl Butyryl
Penta International
ACETYL BUTYRYL NATURAL , Kosher
Penta International
ACETYL BUTYRYL, Kosher
SAFC Global
2,3-Hexanedione
≥90%, FG, Kosher
Odor: butter; creamy; oily; sweet
SAFC Global
2,3-Hexanedione, natural, 98%
Vigon International
Acetyl Butyryl (2,3-Hexanedione)
Odor: Dry sweet butter oily creamy fatty fruity jam
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Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
  R 10 - Flammable.
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 16 - Keep away from sources of ignition - No Smoking.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
 
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.
Human Experience:
 4 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
  oral-rat LD50  > 5000 mg/kg
(Moreno, 1977d)

oral-rat LD50  > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 697, 1979.

Dermal Toxicity:
  skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 697, 1979.

Inhalation Toxicity:
  Not determined
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Safety in Use Information:
Category:flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU):8.50 (μg/capita/day)
Recommendation for acetyl butyryl usage levels up to:
  1.0000 % in the fragrance concentrate.
Recommendation for acetyl butyryl flavor usage levels up to:
  50.0000 ppm in the finished product.
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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 11 (FGE.11): Aliphatic dialcohols, diketones, and hydroxyketones from chemical group 10 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
page or pdf
Flavouring Group Evaluation 11, Revision 1 (FGE.11Rev1) - Aliphatic dialcohols, diketones, and hydroxyketones from chemical group 10 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
page or pdf
EPI System:View
Chemicalize.org:Calculate predicted properties
NLM Hazardous Substances Data Bank:Search
Cancer Citations:Search
Toxicology Citations:Search
Env. Mutagen Info. Center:Search
EPA Substance Registry Services (TSCA):3848-24-6
EPA ACToR:Toxicology Data
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1224
WGK Germany:2
 hexane-2,3-dione
DTP/NCI:31665
Chemidplus:0003848246
EPA/NOAA CAMEO:hazardous materials
RTECS:MO3140000 for cas# 3848-24-6
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References:
 hexane-2,3-dione
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:3848-24-6
Pubchem (cid):19707
Pubchem (sid):134985976
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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:2914.19.0000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 acetoinFL/FR
 acetoin acetateFL/FR
2-acetyl furanFL/FR
 acetyl isobutyrylFL/FR
 acetyl isovalerylFL
 acetyl nonyrylFL/FR
 acetyl propionylFL/FR
3-acetyl-2,5-dimethyl furanFL/FR
2-acetyl-3-methyl pyrazineFL/FR
2-acetyl-3,4,5,6-tetrahydropyridineFL
2-acetyl-3,5(or 6)-dimethyl pyrazineFL/FR
 allyl 2-furoateFL
 allyl methyl trisulfideFL
 allyl nonanoateFL/FR
isoamyl 3-(2-furan) propionateFL/FR
6-amyl-alpha-pyroneFL/FR
 benzyl disulfideFL
 benzyl lactateFL/FR
 benzylidene acetoneFL
isobutyl benzyl carbinolFL/FR
 butyl butyryl lactateFL/FR
 butyl lactateFL/FR
 butyl laevo-lactateFL/FR
 butyl levulinateFL/FR
 butyl octanoateFL/FR
 butyl undecylenateFL/FR
 butyric acidFL/FR
2-oxobutyric acidFL/FR
isobutyric acidFL/FR
 butyroinFL
gamma-butyrolactoneFL/FR
 caramel dioneFL
 caramel furanoneFL
 caramel pentadioneFL/FR
 cinnamyl benzoateFL/FR
 coconut decanone methylFR
 coconut naphthalenoneFL/FR
 coffee furanoneFL/FR
 creamy lactoneFL/FR
 cyclohexyl acetic acidFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
(Z)-dairy lactoneFL/FR
delta-decalactoneFL/FR
gamma-decalactoneFL/FR
6-decenoic acidFL
 diacetylFL
 diacetyl trimerFL
5,5-dibutyl dihydrofuran-2(3H)-oneFL
2,5-diethyl tetrahydrofuranFL
2,5-diethyl-3-methyl pyrazineFL
2,5-dihydroxy-1,4-dithianeFL
alpha,alpha-dimethyl anisyl acetoneFL/FR
ortho-dimethyl hydroquinoneFL/FR
2,3-dimethyl pyrazineFL/FR
delta-dodecalactoneFL/FR
delta-2-dodecenolactoneFL/FR
 ethyl (E)-2-crotonateFL/FR
 ethyl 2-hydroxy-2-methyl butyrateFL/FR
 ethyl 4-pentenoateFL/FR
 ethyl cyclopentenoloneFL/FR
 ethyl lactateFL/FR
 ethyl maltolFL/FR
 ethyl palmitateFL/FR
2-ethyl pyrazineFL/FR
 ethyl pyruvateFL/FR
(E)-ethyl tiglateFL/FR
 ethyl undecanoateFL/FR
 ethyl undecylenateFL/FR
 ethyl vanillinFL/FR
 ethyl vanillin isobutyrateFL/FR
 ethyl vanillin propylene glycol acetalFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-oneFL
 farnesyl acetoneFL/FR
 fenugreek absoluteFL/FR
 furfuryl acetoneFL
 furfuryl alcoholFL
 furfuryl octanoateFL
 furfuryl valerateFL
 geranyl crotonateFR
gamma-heptalactoneFL/FR
 heptanal 2,3-butane diol acetalFL
2,3-heptane dioneFL/FR
(Z)-4-heptenalFL/FR
(Z)-4-heptenal diethyl acetalFL/FR
(Z)-4-hepten-1-olFL/FR
3-heptyl dihydro-5-methyl-2(3H)-furanoneFL/FR
3,4-hexane dioneFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
5-hydroxymethyl furfuralFL
 immortelle absoluteFL/FR
 jasmin pyranoneFL/FR
 levulinic acidFL/FR
 linalyl butyrateFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 mango furanoneFL
 maple furanoneFL/FR
(R)-massoia lactoneFL
 menthone lactoneFL/FR
 mesitene lactoneFR
 methionalFL/FR
 methyl (Z)-5-octenoateFL/FR
 methyl 2-thiofuroateFL
3-methyl butyl 2-furyl butyrateFL
6-methyl coumarinFL
5-methyl furfuralFL/FR
2-methyl heptanoic acidFL/FR
 methyl laurateFL/FR
4-methyl octanoic acidFL/FR
2-methyl quinoxalineFL
5-methyl quinoxalineFL/FR
3-(methyl thio) hexanalFL
2-methyl-2-pentenoic acidFL/FR
4-methyl-2,6-dimethoxyphenolFL/FR
 mint lactoneFL/FR
 neryl propionateFL/FR
delta-nonalactoneFL/FR
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
2-nonanolFL/FR
1-nonen-3-olFL/FR
 nutty cyclohexenoneFL/FR
2,4-octadien-1-olFL
gamma-octalactoneFL/FR
3-octen-2-olFL/FR
1-octen-3-yl butyrateFL/FR
 octyl 2-furoateFL
 octyl butyrateFL/FR
 octyl isobutyrateFL/FR
 peanut oxazoleFL
2-pentanoyl furanFL
(E)-2-pentenoic acidFL
 popcorn pyrimidineFL/FR
 prenyl isobutyrateFL/FR
 rosefuranFL/FR
 shoyu furanoneFL/FR
 sodium 4-methyl-2-oxovalerateFL
 strawberry furanoneFL/FR
 strawberry furanone acetateFL/FR
delta-tetradecalactoneFL/FR
 tetrahydrofurfuryl acetateFL/FR
 tetrahydrofurfuryl alcoholFL/FR
3-tetrahydrothiophenoneFL
2-thiophene thiolFL
(E)-tiglic acidFL/FR
 toffee furanoneFL/FR
 tonka bean absoluteFR
 tonka bean resinoidFR
(E,E)-2,4-undecadienalFL
2,4-undecadienalFL
delta-undecalactoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
 undecanoic acidFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
 vanilla oleoresin baliFL/FR
para-vanillic acidFL/FR
 vanillinFL/FR
 vanillyl acetateFL/FR
para-vanillyl alcoholFL/FR
 vanillyl isobutyrateFL/FR
 vanillylidene acetoneFL/FR
 waxy lactoneFL/FR
 whiskey lactoneFL/FR
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Potential Uses:
 butterFR
 butterscotchFR
 caramelFL
 cheeseFL
 coffeeFR
 cotton candyFR
 custardFL
 floralFR
 pineappleFR
 vanillaFR
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Natural Occurrence in: note
 beer
 coffee
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Synonyms:
 acetyl butyryl
 acetyl butyryl natural
 acetyl-N-butyryl
 butyryl acetyl
2,3-hexane dione
 hexane-2,3-dione
2,3-hexanedione
 methyl propyl diketone
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Synonyms   Articles   Notes   Search   Top
click on the picture(s) below to
interact with the 3D model
Picture of molecule
Similar Items: note
acetyl isobutyryl
hexane-3,4-dione
Soluble in:
 alcohol
 water, slightly
 water, 2.113e+005 mg/L @ 25 °C (est)
Insoluble in:
 water
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