3-(methylthio) benzoic acid

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Names

[ CAS No. ]:
825-99-0

[ Name ]:
3-(methylthio) benzoic acid

[Synonym ]:
3-methylsulfanylbenzoic acid
Benzoic acid, 3-(methylthio)-
MFCD00156993
3-(Methylsulfanyl)benzoic acid
3-(methylthio) benzoic acid
3-(Methylthio)benzoicacid

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
321.5±25.0 °C at 760 mmHg

[ Melting Point ]:
126-130ºC

[ Molecular Formula ]:
C₈H₈O₂S

[ Molecular Weight ]:
168.213

[ Flash Point ]:
148.2±23.2 °C

[ Exact Mass ]:
168.024506

[ PSA ]:
62.60000

[ LogP ]:
2.46

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.613

MSDS

Click to get detail MSDS

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xn

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

methyl 3-methylsulfanylbenzoate
3-Aminobenzoic acid
Dimethyl sulfate
Carbon dioxide
3-Bromothioanisole
3-(Methylsulfanyl)benzaldehyde
potassium ethylxanthate
3-chlorosulfonylbenzoic acid
3,3'-Disulfanediyldibenzoic acid
3-Cyanothioanisole

DownStream

4-(Methylsulfinyl)benzoic acid
Benzoic acid,3-(methylthio)-, ethyl ester
3-Methylsulfonyl benzoic acid
3-(Methylsulfanyl)benzaldehyde
2-(Diethylamino)ethyl=m-(methylthio)benzoate
3-(Diethylamino)propyl=m-(methylthio)benzoate
3-MERCAPTOBENZYLALCOHOL
methyl 3-methylsulfanylbenzoate
(3-Methylsulfanyl-phenyl)-Methanol

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%