EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

isoamyl 3-methyl thiopropionate
propanoic acid, 3-(methylthio)-, pentyl ester

Sponsors

CAS Number: 93762-35-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:297-748-5
XlogP3-AA:2.50 (est)
Molecular Weight:190.30586000
Formula:C9 H18 O2 S
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.97300 to 0.97900 @ 25.00 °C.
Pounds per Gallon - (est).: 8.096 to 8.146
Refractive Index:1.45600 to 1.46100 @ 20.00 °C.
Boiling Point: 126.00 to 129.00 °C. @ 30.00 mm Hg
Boiling Point: 228.00 to 230.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.014000 mm/Hg @ 25.00 °C. (est)
Vapor Density:6.5 ( Air = 1 )
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.166 (est)
Soluble in:
 alcohol
 water, slightly
 water, 158.7 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
ethyl 3-methyl thiopropionate
methyl-3-methyl thiopropionate
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:high ,
recommend smelling in a 0.10 % solution or less
pineapple fruit tropical fruit sulfurous
Odor Description:at 0.10 % in dipropylene glycol. pineapple tropical fruit sulfurous
Odor and/or flavor descriptions from others (if found).
Frutarom
ISOAMYL 3-THIOMETHYLPROPIONATE ≥98.00% (sum of isomers), NI, Kosher
Odor Description:Fruity, Pineapple, Sulphurous, Sweet
Suggested Uses: Pineapple, Tropical Fruits
 
Cosmetic Information:
None found
 
Suppliers:
Endeavour Specialty Chemicals
Isoamyl 3-(methylthio)propionate 98% F&F
Speciality Chemical Product Groups
Frutarom
ISOAMYL 3-THIOMETHYLPROPIONATE
≥98.00% (sum of isomers), NI, Kosher
Odor: Fruity, Pineapple, Sulphurous, Sweet
Use: Suggested Uses: Pineapple, Tropical Fruits
Robinson Brothers
IsoAmyl 3-(methylthio)propionate F&F
https://www.robinsonbrothers.uk/chemistry-competences
Synerzine
isoAmyl 3-thiomethyl Propionate
Taytonn
isoAmyl 3-methylthiopropionate
Odor: Fruity, Sulphurous, Sweet
Treatt
Isoamyl 3-methylthio propionate
Halal, Kosher
 
Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/39 - Wear suitable clothing 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.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavoring agents
Recommendation for isoamyl 3-methyl thiopropionate usage levels up to:
 not for fragrance use.
 
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :548370
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
pentyl 3-methylsulfanylpropanoate
Chemidplus:0093762357
 
References:
 pentyl 3-methylsulfanylpropanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):548370
Pubchem (sid):135234222
 
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
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.50.3000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
For Flavor
No flavor group found for these
ethyl 2-methyl-2-(methyl thio) propionate
FL
ethyl 3-octenoate
FL
S-
prenyl thioisobutyrate
FL
S-
prenyl thioisovalerate
FL
sorbyl propionate
FL
allyl thiohexanoate
FL
3-
mercapto-3-methyl-1-butyl acetate
FL
citrus
citrus
3-
mercaptoheptyl acetate
FL
fruity
ethyl (E)-2-octenoate
FL
furfuryl valerate
FL
3-
mercaptohexyl hexanoate
FL
methionyl butyrate
FL
sulfurous
S-
ethyl thioacetate
FL
methyl 2-(methyl thio) butyrate
FL
methyl 4-(methyl thio) butyrate
FL
methyl thiomethyl butyrate
FL
 
Potential Uses:
 fruit tropical fruit
FLpineapple
 
Occurrence (nature, food, other):note
 pineapple fruit
Search Trop Picture
 
Synonyms:
isoamyl 3-(methylthio)propionate
isoamyl 3-methylthio propionate
isoamyl 3-methylthiopropionate
isoamyl 3-thiomethyl propionate
isoamyl 3-thiomethylpropionate
isopentyl 3-(methyl thio) propionate
 pentyl 3-(methylsulfanyl)propanoate
 pentyl 3-(methylthio)propionate
 pentyl 3-methylsulfanylpropanoate
 propanoic acid, 3-(methylthio)-, pentyl ester
 

Articles:

 None found yet.
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy