2-(Methylsulfanyl)benzoic acid

Modify Date: 2024-01-02 16:47:02

2-(Methylsulfanyl)benzoic acid Structure
2-(Methylsulfanyl)benzoic acid structure
Common Name 2-(Methylsulfanyl)benzoic acid
CAS Number 3724-10-5 Molecular Weight 168.213
Density 1.3±0.1 g/cm3 Boiling Point 297.4±23.0 °C at 760 mmHg
Molecular Formula C8H8O2S Melting Point 169-173 °C(lit.)
MSDS Chinese USA Flash Point 133.7±22.6 °C

 Names

Name 2-(methylthio)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 297.4±23.0 °C at 760 mmHg
Melting Point 169-173 °C(lit.)
Molecular Formula C8H8O2S
Molecular Weight 168.213
Flash Point 133.7±22.6 °C
Exact Mass 168.024506
PSA 62.60000
LogP 2.58
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.613

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH4390000
CHEMICAL NAME :
Benzoic acid, o-(methylthio)-
CAS REGISTRY NUMBER :
3724-10-5
BEILSTEIN REFERENCE NO. :
0972385
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H8-O2-S
MOLECULAR WEIGHT :
168.22
WISWESSER LINE NOTATION :
QVR BS1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2500 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
BSRSA6 Bulletin de la Societe Royale des Sciences de Liege. (Societe Royale des Sciences de Liege, Universite de Liege, 15, Ave des Tilleuls, B-4000 Liege, Belgium) V.1- 1932- Volume(issue)/page/year: 47,202,1978
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2250 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
BSRSA6 Bulletin de la Societe Royale des Sciences de Liege. (Societe Royale des Sciences de Liege, Universite de Liege, 15, Ave des Tilleuls, B-4000 Liege, Belgium) V.1- 1932- Volume(issue)/page/year: 47,202,1978

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS DH4390000
HS Code 2930909090

 Synthetic Route

 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%

 Synonyms

2-(Methylthio)benzoic Acid
2-methylsulfanylbenzoic acid
2-(Methylsulfanyl)benzoic acid
MFCD00029934
Benzoic acid, 2-(methylthio)-