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

methyl isobutyl carbinyl acetate
acetic acid, 1,3-dimethylbutyl ester

Supplier Sponsors

Name:4-methylpentan-2-yl acetate
CAS Number: 108-84-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:203-621-7
FDA UNII:IP9ZB28RWN
Nikkaji Web:J48.640J
Beilstein Number:1749848
MDL:MFCD00053723
CoE Number:2073
XlogP3-AA:2.20 (est)
Molecular Weight:144.21392000
Formula:C8 H16 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: -64.00 °C. @ 760.00 mm Hg
Boiling Point: 147.00 to 148.00 °C. @ 760.00 mm Hg
Vapor Pressure:5.102000 mmHg @ 25.00 °C. (est)
Flash Point: 94.00 °F. TCC ( 34.44 °C. )
logP (o/w): 2.511 (est)
Soluble in:
 alcohol
 water, 1300 mg/L @ 20 °C (exp)
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium
sweet fruity banana
Odor Description:at 100.00 %. sweet fruity banana
Flavor Type: fruity
sweet fruity banana
Taste Description: sweet fruity banana
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Penta International
METHYL AMYL ACETATE
Santa Cruz Biotechnology
For experimental / research use only.
4-Methyl-2-pentyl Acetate
Synerzine
Methyl Amyl Acetate
TCI AMERICA
For experimental / research use only.
4-Methyl-2-pentyl Acetate >98.0%(GC)
 
Safety Information:
Preferred SDS: View
 
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:
oral-rat LD50 6160 mg/kg
Union Carbide Data Sheet. Vol. 7/28/1966

Dermal Toxicity:
skin-rabbit LD50 > 20 ml/kg
AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

Inhalation Toxicity:
inhalation-human TCLo 100 ppm
SENSE ORGANS AND SPECIAL SENSES: CONJUNCTIVE IRRITATION: EYE SENSE ORGANS AND SPECIAL SENSES: OTHER CHANGES: OLFACTION LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Journal of Industrial Hygiene and Toxicology. Vol. 28, Pg. 262, 1946.

inhalation-rat LCLo 2000 ppm/4H
Union Carbide Data Sheet. Vol. 7/28/1966

 
Safety in Use Information:
Category: fragrance agents
Recommendation for methyl isobutyl carbinyl acetate usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Recommendation for methyl isobutyl carbinyl acetate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
NIOSH International Chemical Safety Cards:search
NIOSH Pocket Guide:search
NLM Hazardous Substances Data Bank:Search
EPA Substance Registry Services (TSCA):108-84-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7959
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1233
WGK Germany:2
4-methylpentan-2-yl acetate
Chemidplus:0000108849
EPA/NOAA CAMEO:hazardous materials
RTECS:108-84-9
 
References:
 4-methylpentan-2-yl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:108-84-9
Pubchem (cid):7959
Pubchem (sid):134973329
 
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:2915.39.9000
Haz-Map:View
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Formulations/Preparations:
•grades or purity: 95-99+% •grade: technical
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 eucalyptus ixophleba
Search Trop Picture
 
Synonyms:
 acetic acid 1,3-dimethyl butyl ester
 acetic acid 1,3-dimethylbutyl ester
 acetic acid, 1,3-dimethylbutyl ester
1,3-dimethyl butyl acetate
1,3-dimethylbutyl acetate
1,3-dimethylbutyl ethanoate
 methyl amyl acetate
 methyl isobutyl carbinyl acetate
4-methyl-2-amyl acetate
4-methyl-2-pentanol acetate
4-methyl-2-pentanol, acetate
4-methyl-2-pentyl acetate
 methylisoamyl acetate
 methylisobutylcarbinol acetate
 methylisobutylcarbinyl acetate
4-methylpentan-2-yl acetate
2-pentanol, 4-methyl-, acetate
 
 
Notes:
None found
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