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tiglic acid
2-methyl-2-butenoic acid

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CAS Number: 13201-46-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:236-167-3
CoE Number:10168
XlogP3-AA:1.00 (est)
Molecular Weight:100.11716000
Formula:C5 H8 O2
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
Composition of mixture to be specified.
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
PubMed:Search
NCBI:Search
DG SANTE Food Flavourings:08.120 2-methyl-2-butenoic acid
 
Physical Properties:
Assay: 99.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Boiling Point: 191.00 to 193.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.152000 mmHg @ 25.00 °C. (est)
Flash Point: 204.00 °F. TCC ( 95.56 °C. )
logP (o/w): 1.076 (est)
Soluble in:
 alcohol
 water, slightly
 water, 1.845e+004 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
(E)-tiglic acid
(Z)-tiglic acid
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Tiglic Acid
CJ Latta & Associates
TIGLIC ACID
M&U International
Tiglic Acid, Kosher
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
Safety Information:
 
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:
flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 6.10 (μg/capita/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
 
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):

Scientific Opinion on Flavouring Group Evaluation 71: Consideration of aliphatic, linear, alpha,beta-unsaturated carboxylic acids and related esters
View page or View pdf

Flavouring Group Evaluation 72 (FGE.72): Consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids, and related esters evaluated by the JECFA (61st meeting) structurally related to branched- and straight-chain unsaturated carboxylic acids. Esters of these and straight-chain aliphatic saturated alcohols evaluated by EFSA in FGE.05Rev2 (2010)
View page or View 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
View page or View pdf

EPI System: View
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):13201-46-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6656
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3261
WGK Germany:2
2-methylbut-2-enoic acid
Chemidplus:0013201462
 
References:
 2-methylbut-2-enoic acid
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:13201-46-2
Pubchem (cid):6656
Pubchem (sid):135071054
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
KEGG (GenomeNet):C08279
HMDB (The Human Metabolome Database):HMDB01470
FooDB:FDB000774
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 burdock plant
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 carrot seed
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 celery plant
Search Trop Picture
 chamomile
Search Trop Picture
 chamomile garden chamomile plant
Search Trop Picture
 
Synonyms:
2-butenoic acid, 2-methyl-
 crotonic acid, 2-methyl-
2,3-dimethylacrylic acid
2-methyl crotonic acid
alpha-methyl crotonic acid
2-methyl-2-butenoic acid
2-methylbut-2-enoic acid
2-methylcrotonic acid
alpha-methylcrotonic acid
 methylmethacrylic acid
 tiglinic acid
 
 
Notes:
Flavouring ingredient A thick, syrupy poisonous liquid, C5H8O2, derived from croton oil, having a spicy odor and used in making perfumes and flavoring agents.; Tiglic acid has a double bond between the second and third carbons of the chain. Together with angelic acid form a pair of cis-trans isomers. Tiglic acid is a volatile and crystallizable substance with a sweet, warm spicy odour. It is used in making perfumes and flavoring agents.; Tiglic acid is a monocarboxylic unsaturated organic acid. It is found in croton oil and in several other natural products. It was also isolated from the defensive secretion of certain beetles.; Tiglic acid is a skin and eye irritant. The inhalation of the substance causes respiratory tract irritation. It is listed on the Toxic Substances Control Act (TSCA).
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