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

3-methyl cyclohexanol
cyclohexanol, 3-methyl-

Supplier Sponsors

Name:3-methylcyclohexan-1-ol
CAS Number: 591-23-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:209-709-1
Nikkaji Web:J46.538K
Beilstein Number:2036372
MDL:MFCD00001446
XlogP3-AA:1.80 (est)
Molecular Weight:114.18778000
Formula:C7 H14 O
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
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 98.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Boiling Point: 162.00 to 164.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.475000 mmHg @ 25.00 °C. (est)
Flash Point: 145.00 °F. TCC ( 63.00 °C. )
logP (o/w): 1.818 (est)
Soluble in:
 alcohol
 water, 5990 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: solvent
Odor Strength:medium
dry solvent musty rummy fusel fruity
Odor Description:at 100.00 %. dry solvent musty rummy fusel fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
3-Methylcyclohexanol BP 170-172deg
EMD Millipore
For experimental / research use only.
3-methylcyclohexanol
Penta International
3-METHYLCYCLOHEXANOL
Santa Cruz Biotechnology
For experimental / research use only.
3-Methylcyclohexanol, mixture of cis and trans
Synerzine
3-Methylcyclohexanol
TCI AMERICA
For experimental / research use only.
3-Methylcyclohexanol (cis- and trans- mixture) >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:
intramuscular-mouse LD50 1000 mg/kg
Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavoring agents
Recommendation for 3-methyl cyclohexanol usage levels up to:
 not for fragrance use.
 
 
Safety References:
EPI System: View
NIOSH International Chemical Safety Cards:search
EPA Substance Registry Services (TSCA):591-23-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :11566
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
3-methylcyclohexan-1-ol
Chemidplus:0000591231
RTECS:591-23-1
 
References:
 3-methylcyclohexan-1-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):11566
Pubchem (sid):134977263
 
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):HMDB31538
FooDB:FDB008146
Export Tariff Code:2906.12.0000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
For Odor
fruity
ethyl isobutyrate
FL/FR
methyl butyrate
FL/FR
propyl acetate
FL/FR
herbal
hexanol
FL/FR
roasted
2-
methyl-1-butanol
FL/FR
rummy
rum extract
FL/FR
For Flavor
No flavor group found for these
2-
methyl-1-butanol
FL/FR
estery
estery
propyl acetate
FL/FR
ethereal
ethyl isobutyrate
FL/FR
fusel
methyl butyrate
FL/FR
green
hexanol
FL/FR
rummy
rum extract
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 cornmint oil india @ trace%
Data GC Search Trop Picture
 cranberry fruit
Search Trop Picture
 
Synonyms:
 cyclohexanol, 3-methyl-
 cyclohexanol, m-methyl-
 hexahydro-m-cresol
meta-methyl cyclohexanol
3-methyl-1-cyclohexanol
3-methylcyclohexan-1-ol
3-methylcyclohexanol
m-methylcyclohexanol
 
 
Notes:
Isol. from oil of Mentha pulegium (European pennyroyal) (prob. as trans-form)
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