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4-hexyl benzoic acid
benzoic acid, 4-hexyl-

Supplier Sponsors

Name:4-hexylbenzoic acid
CAS Number: 21643-38-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:244-490-6
FDA UNII: VF567YY01P
Nikkaji Web:J42.049B
Beilstein Number:2046454
MDL:MFCD00013997
XlogP3:5.10 (est)
Molecular Weight:206.28486000
Formula:C13 H18 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 330.30 °C. @ 760.00 mm Hg (est)
Flash Point: 316.00 °F. TCC ( 157.50 °C. ) (est)
logP (o/w): 5.010 (est)
Soluble in:
 water, 2.777 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Santa Cruz Biotechnology
For experimental / research use only.
4-hexylbenzoic acid
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Hexylbenzoic Acid liquid crystal, 99%
sds
TCI AMERICA
For experimental / research use only.
4-Hexylbenzoic Acid >98.0%(GC)(T)
sds
 
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:
intravenous-mouse LD50 56 mg/kg
U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#09965

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
information only not used for fragrances or flavors
Recommendation for 4-hexyl benzoic acid usage levels up to:
 not for fragrance use.
 
Recommendation for 4-hexyl benzoic acid flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):21643-38-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :30725
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
4-hexylbenzoic acid
Chemidplus:0021643389
RTECS:DH1485000 for cas# 21643-38-9
 
References:
 4-hexylbenzoic acid
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):30725
Pubchem (sid):134993748
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2916.39.7900
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzoic acid, 4-hexyl-
p-hexyl benzoic acid
para-hexyl benzoic acid
4-hexylbenzoic acid
p-hexylbenzoic acid
 
 
Notes:
None found
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