2-(carboxymethylthio)benzoic acid
Names
[ CAS No. ]:
135-13-7
[ Name ]:
2-(carboxymethylthio)benzoic acid
[Synonym ]:
EINECS 205-178-5
2-Carboxymethylmercapto-benzoesaeure
Acetic acid,(2-carboxyphenyl)thio
2-Carboxyphenylthioglycolic acid
2-<(carboxymethyl)thio>benzoic acid
o-Carboxyphenylthioglycollic acid
(o-Carboxyphenylthio)acetic acid
2-(Carboxymethylthio)benzoic acid
2-(3-FLUOROPHENYL)ACETOPHENONE
2-(carbomethylthio)benzoic acid
MFCD00021761
2-carboxymethylsulfanyl-benzoic acid
(S-Phenyl-thioglykolsaeure)-o-carbonsaeure
Chemical & Physical Properties
[ Density]:
1.49 g/cm3
[ Boiling Point ]:
423ºC at 760 mmHg
[ Melting Point ]:
208 °C
[ Molecular Formula ]:
C9H8O4S
[ Molecular Weight ]:
212.22200
[ Flash Point ]:
209.6ºC
[ Exact Mass ]:
212.01400
[ PSA ]:
99.90000
[ LogP ]:
1.56150
[ Vapour Pressure ]:
6.55E-08mmHg at 25°C
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DG4975500
- CHEMICAL NAME :
- Benzoic acid, (2-carboxymethylthio)-
- CAS REGISTRY NUMBER :
- 135-13-7
- BEILSTEIN REFERENCE NO. :
- 2109941
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H8-O4-S
- MOLECULAR WEIGHT :
- 212.23
- WISWESSER LINE NOTATION :
- QV1SR BVQ
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 :
- 250 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00457
Safety Information
[ Hazard Codes ]:
T
[ Safety Phrases ]:
S22-S24/25
[ RTECS ]:
DG4975500
[ HS Code ]:
2930909090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2930909090
[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%