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

meta-cymene
3-methylisopropylbenzene

Supplier Sponsors

Name:1-methyl-3-propan-2-ylbenzene
CAS Number: 535-77-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:208-617-9
FDA UNII:10ZH8R921S
Nikkaji Web:J43.515E
Beilstein Number:1851357
MDL:MFCD00008891
XlogP3:4.00 (est)
Molecular Weight:134.22158000
Formula:C10 H14
NMR Predictor:Predict (works with chrome or firefox)
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
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 174.00 to 176.00 °C. @ 760.00 mm Hg
Vapor Pressure:1.720000 mm/Hg @ 25.00 °C.
Flash Point: 118.00 °F. TCC ( 47.80 °C. ) (est)
logP (o/w): 4.500
Soluble in:
 alcohol
 water, 42.5 mg/L @ 25 °C (exp)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
m-CYMENE >99.0%(GC)
Santa Cruz Biotechnology
For experimental / research use only.
m-Cymene
Sigma-Aldrich: Aldrich
For experimental / research use only.
m-Cymene 99%
TCI AMERICA
For experimental / research use only.
m-Cymene >99.0%(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 2970 mg/kg
BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(12), Pg. 57, 1986.

oral-mouse LD50 3272 mg/kg
BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(12), Pg. 57, 1986.

intraperitoneal-mouse LD50 1198 mg/kg
BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(12), Pg. 57, 1986.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
inhalation-mouse LC50 12000 mg/m3
BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(12), Pg. 57, 1986.

 
Safety in Use Information:
Category: flavor and fragrance agents
 
 
Safety References:
EPI System: View
NLM Hazardous Substances Data Bank:Search
Toxicology Citations:Search
NLM Developmental and Reproductive Toxicity:Search
EPA Substance Registry Services (TSCA):535-77-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :10812
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
1-methyl-3-propan-2-ylbenzene
Chemidplus:0000535773
RTECS:DA6127310 for cas# 535-77-3
 
References:
 1-methyl-3-propan-2-ylbenzene
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):10812
Pubchem (sid):134977417
Pherobase:View
 
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):HMDB37051
FooDB:FDB016033
Export Tariff Code:2902.90.2000
Haz-Map:View
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 basil oil
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 basil plant
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 cassis bud oil @ trace-0.17%
Data GC Search Trop Picture
 currant black currant fruit
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 currant black currant leaf
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 ferula cupularis flower oil @ 5.21%
Data GC Search Trop Picture
 gynandropsis gynandra
Search Trop Picture
 orange oil
Search Trop Picture
 petitgrain bigarade oil @ 0.50%
Data GC Search Trop Picture
 plumcot fruit
Search PMC Picture
 radix angelicae pubescentis
Search Trop Picture
 senecio vernalis waldst. & kit.
Search Trop Picture
 ulva rigida oil greece @ 15.00%
Data GC Search PMC Picture
 
Synonyms:
 benzene, 1-methyl-3-(1-methylethyl)-
beta-cymene
m-cymene
beta-cymol
m-cymol
meta-methyl isopropyl benzene
3-methyl-1-(methylethyl)benzene
1-methyl-3-(1-methyl ethyl) benzene
1-methyl-3-(1-methylethyl)benzene
1-methyl-3-isopropylbenzene
1-methyl-3-propan-2-ylbenzene
3-methylisopropylbenzene
m-methylisopropylbenzene
3-isopropyl toluene
meta-isopropyl toluene
1-isopropyl-3-methylbenzene
3-isopropyltoluene
m-isopropyltoluene
 
 
Notes:
Present in oil of Ribes nigrum (blackcurrant)
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