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%

Related Compounds

  • 3-(methylthio) benzoic acid
  • 4-Bromo-3-(methylthio)benzoic acid
  • 2-Fluoro-3-(methylthio)benzoic acid
  • 2-methyl-3-(methylthio)benzoic acid
  • 4-CHLORO-3-(METHYLTHIO)BENZOIC ACID
  • 2,6-difluoro-3-(Methylthio)benzoic acid
  • 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbut-2-enamido]-2-(thiophen-2-yl)acetic acid
  • 4-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5,5-dimethylhexanamido]-2-methylbut-2-enoic acid
  • 4-{3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-5-methylhexanamido}-2-methylbut-2-enoic acid
  • 4-({2-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]-1,3-thiazol-4-yl}formamido)-2-methylbut-2-enoic acid
  • 4-({2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]-1,3-thiazol-4-yl}formamido)-2-methylbut-2-enoic acid
  • 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methyl-N-(prop-2-yn-1-yl)but-2-enamido]acetic acid
  • (2R)-2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbut-2-enamido]-4-(methylsulfanyl)butanoic acid
  • 3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbut-2-enamido]-4,4,4-trifluorobutanoic acid
  • 1-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbut-2-enoyl]azetidine-2-carboxylic acid
  • 3-[(2R)-N-benzyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-phenylpropanamido]propanoic acid
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