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

methyl benzyl carbinol
benzeneethanol, a-methyl-

Supplier Sponsors

Name:1-phenylpropan-2-ol
CAS Number: 698-87-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-821-0
FDA UNII:300Y7TB8EY
Nikkaji Web:J69.579C
Beilstein Number:1858667
MDL:MFCD00004540
XlogP3:2.00 (est)
Molecular Weight:136.19384000
Formula:C9 H12 O
NMR Predictor:Predict (works with chrome or firefox)
Category:natural substances and extractives
 
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
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
Specific Gravity:0.99200 to 0.99400 @ 20.00 °C.
Pounds per Gallon - (est).: 8.264 to 8.281
Refractive Index:1.52000 to 1.52300 @ 20.00 °C.
Boiling Point: 73.00 to 74.00 °C. @ 0.50 mm Hg
Boiling Point: 219.00 to 220.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.015000 mmHg (est)
Flash Point: 185.00 °F. TCC ( 85.00 °C. ) (est)
logP (o/w): 1.970
Soluble in:
 water, 5838 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:low
rose floral
Odor Description:at 100.00 %. weak rose
Flavor Type: fruity
sweet pineapple
Taste Description: sweet pineapple
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
1-Phenyl-2-propanol 95%
Frinton Laboratories
For experimental / research use only.
1-Phenyl-2-propanol
Penta International
1-PHENYL-2-PROPANOL
Santa Cruz Biotechnology
For experimental / research use only.
1-Phenyl-2-propanol
Sigma-Aldrich: Aldrich
For experimental / research use only.
1-Phenyl-2-propanol 98%
Synerzine
1-Phenyl-2-propanol
TCI AMERICA
For experimental / research use only.
1-Phenyl-2-propanol >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:
intraperitoneal-mouse LD50 520 mg/kg
BEHAVIORAL: ANTIPSYCHOTIC BEHAVIORAL: ATAXIA
Journal of Pharmaceutical Sciences. Vol. 60, Pg. 799, 1971.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: natural substances and extractives
Recommendation for methyl benzyl carbinol usage levels up to:
 not for fragrance use.
 
Recommendation for methyl benzyl carbinol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
Env. Mutagen Info. Center:Search
EPA Substance Registry Services (TSCA):698-87-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :94185
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
1-phenylpropan-2-ol
Chemidplus:0000698873
RTECS:SG8589500 for cas# 698-87-3
 
References:
 1-phenylpropan-2-ol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:698-87-3
Pubchem (cid):94185
Pubchem (sid):135051439
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):Search
Export Tariff Code:2906.29.6000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
FRapricot
FRchestnut blossom
FRpeach
FRpineapple
 
Occurrence (nature, food, other):note
 ficus punctata
Search Trop Picture
 
Synonyms:
 benzeneethanol, a-methyl-
 benzyl methyl carbinol
 benzylethyl alcohol
2-hydroxy-1-phenyl propane
2-hydroxy-1-phenylpropane
alpha-methyl benzene ethanol
alpha-methyl phenethyl alcohol
a-methylbenzeneethanol
a-methylphenethyl alcohol
 phenethyl alcohol, a-methyl-
1-phenyl-2-propanol
1-phenylpropan-2-ol
 propan-2-ol, 1-phenyl-
2-propanol, 1-phenyl-
 
 
Notes:
None found
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