3-Chloro-2-methylbenzoic acid
Names
[ CAS No. ]:
7499-08-3
[ Name ]:
3-Chloro-2-methylbenzoic acid
[Synonym ]:
Benzoic acid, 3-chloro-2-methyl-
3-Chlor-o-toluylsaeure
2-methyl-3-chlorobenzoic acid
3-chloro-2-methyl-benzoic acid
o-Toluic acid,3-chloro
3-Chlor-2-methyl-benzoesaeure
3-Chloro-2-methylbenzoic acid
3-Chloro-o-toluic acid
Benzoic acid,3-chloro-2-methyl
MFCD00053312
Chemical & Physical Properties
[ Density]:
1.3±0.1 g/cm3
[ Boiling Point ]:
290.9±20.0 °C at 760 mmHg
[ Melting Point ]:
163-166 °C(lit.)
[ Molecular Formula ]:
C8H7ClO2
[ Molecular Weight ]:
170.593
[ Flash Point ]:
129.7±21.8 °C
[ Exact Mass ]:
170.013458
[ PSA ]:
37.30000
[ LogP ]:
3.36
[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C
[ Index of Refraction ]:
1.573
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XU1645000
- CHEMICAL NAME :
- o-Toluic acid, 3-chloro-
- CAS REGISTRY NUMBER :
- 7499-08-3
- BEILSTEIN REFERENCE NO. :
- 1072826
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H7-Cl-O2
- MOLECULAR WEIGHT :
- 170.60
- WISWESSER LINE NOTATION :
- QVR BG F1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 422 mg/kg
- TOXIC EFFECTS :
- Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1020,1968
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H315-H319-H335
[ Precautionary Statements ]:
P261-P305 + P351 + P338
[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves
[ Hazard Codes ]:
Xi: Irritant;
[ Risk Phrases ]:
R36/37/38
[ Safety Phrases ]:
S26-S36
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
3
[ RTECS ]:
XU1645000
[ HS Code ]:
2916399090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2916399090
[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Articles
Eur. J. Med. Chem. 62 , 1-10, (2013)
The potential roles of 11β-HSD1 inhibitors in metabolic syndrome, T2D and obesity were well established and currently several classes of 11β-HSD1 inhibitors have been developed as promising agents aga...
Utilization of 3-chloro-2-methylbenzoic acid by Pseudomonas cepacia MB2 through the meta fission pathway.Appl. Environ. Microbiol. 58(8) , 2501-4, (1992)
Pseudomonas cepacia MB2 grew on 3-chloro-2-methylbenzoate as a sole carbon source by metabolism through the meta fission pathway with the subsequent liberation of chloride. meta pyrocatechase activity...
Monomers and Polymers. III. A New Synthesis for α-Methylstyrenes1, 2. Bachman GB and Hellman HM.J. Am. Chem. Soc. 70(5) , 1772-1774, (1948)