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

2,6-dimethyl benzoic acid
benzoic acid, 2,6-dimethyl-

Supplier Sponsors

Name:2,6-dimethylbenzoic acid
CAS Number: 632-46-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-177-0
FDA UNII: Search
Nikkaji Web:J83.361D
Beilstein Number:1863791
MDL:MFCD00002483
XlogP3:2.20 (est)
Molecular Weight:150.17710000
Formula:C9 H10 O2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: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
Melting Point: 116.00 °C. @ 760.00 mm Hg
Boiling Point: 274.50 °C. @ 760.00 mm Hg
Flash Point: 259.00 °F. TCC ( 126.10 °C. ) (est)
logP (o/w): 2.210
Soluble in:
 water, 981.7 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
2,6-dimethylbenzoic acid 95%
Odor: characteristic
Use: Benzoic acid derivative used in the preparation of antiinflammatory and antirheumatic agents. A potential geothermal
EMD Millipore
For experimental / research use only.
2,6-Dimethylbenzoic Acid
sds
Matrix Scientific
For experimental / research use only.
2,6-Dimethylbenzoic acid, 97%
sds
Santa Cruz Biotechnology
For experimental / research use only.
2,6-Dimethylbenzoic Acid
Sigma-Aldrich: Aldrich
For experimental / research use only.
2,6-Dimethylbenzoic Acid 97%
sds
TCI AMERICA
For experimental / research use only.
2,6-Dimethylbenzoic 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:
intraperitoneal-mouse LD50 178 mg/kg
BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: REGIDITY
Journal of Medicinal Chemistry. Vol. 11, Pg. 1020, 1968.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for 2,6-dimethyl benzoic acid usage levels up to:
 not for fragrance use.
 
Recommendation for 2,6-dimethyl 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 ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12439
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
2,6-dimethylbenzoic acid
Chemidplus:0000632462
RTECS:DG8734010 for cas# 632-46-2
 
References:
 2,6-dimethylbenzoic acid
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):12439
Pubchem (sid):134977318
 
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
CHEBI:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2916.39.7900
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
 horsetail water horsetail
Search Trop Picture
 
Synonyms:
 benzoic acid, 2,6-dimethyl-
2,6-dimethylbenzoic acid
m-xylene-2-carboxylic acid
 

Articles:

PubMed:Unique stepwise substitution reaction of a mono(guanidinate)tetraplatinum complex with amidines, giving mono(amidinate)tetraplatinum complexes through mixed-ligand intermediate complexes.
PubMed:Isolation, characterization and antifungal activity of major constituents of the Himalayan lichen Parmelia reticulata Tayl.
PubMed:Five new compounds from Dendrobium crystallinum.
PubMed:JBIR-26, a novel natural compound from Streptomyces sp. AK-AH76, regulates mammalian circadian clock.
PubMed:[Studies on antibacterial activities of secondary metabolites from fungus Cephalosporium sp. AL031].
PubMed:Steric inhibition of resonance: a revision and quantitative estimation on the basis of aromatic carboxylic acids
 
Notes:
None found
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