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2-butyl phenol
phenol, 2-butyl-

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Name:2-butylphenol
CAS Number: 3180-09-4Picture of molecule3D/inchi
FDA UNII: I1WS5HQ96Y
Nikkaji Web:J34.553I
Beilstein Number:2246561
XlogP3:3.50 (est)
Molecular Weight:150.22078000
Formula:C10 H14 O
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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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
Melting Point: -20.00 °C. @ 760.00 mm Hg
Boiling Point: 235.00 °C. @ 760.00 mm Hg
Boiling Point: 233.00 to 234.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.036000 mmHg @ 25.00 °C. (est)
Flash Point: 233.00 °F. TCC ( 111.90 °C. ) (est)
logP (o/w): 3.491 (est)
Soluble in:
 alcohol
 water, 276.4 mg/L @ 25 °C (est)
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.
2-Butylphenol
 
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:
oral-rat LD50 634 mg/kg
Proceedings of the Society for Experimental Biology and Medicine. Vol. 32, Pg. 592, 1935.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for 2-butyl phenol usage levels up to:
 not for fragrance use.
 
Recommendation for 2-butyl phenol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :18515
National Institute of Allergy and Infectious Diseases:Data
2-butylphenol
Chemidplus:0003180094
 
References:
 2-butylphenol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):18515
Pubchem (sid):134983745
 
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
HMDB (The Human Metabolome Database):Search
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
o-butyl phenol
ortho-butyl phenol
2-butylphenol
2-N-butylphenol
o-butylphenol
ortho-butylphenol
1-hydroxy-2-N-butyl benzene
1-hydroxy-2-N-butylbenzene
 phenol, 2-butyl-
 phenol, 2-butyl- (9CI)
 phenol, o-butyl-
 
 
Notes:
None found
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