2-[2-(Phenylthio)phenyl]acetic acid

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Names

[ CAS No. ]:
1527-17-9

[ Name ]:
2-[2-(Phenylthio)phenyl]acetic acid

[Synonym ]:
[2-(phenylsulfanyl)phenyl]acetic acid
2-(Phenylthio)benzeneacetic acid
2-[2-(Phenylthio)Phenyl]Acetic Acid
2-(Phenylthio)benzolessigsaeure
ACETIC ACID,(o-(PHENYLTHIO)PHENYL)
phenylthiobenzeneacetic acid
<2-(Phenylthio)-phenyl>-essigsaeure
2-(Phenylthio)phenylacetic acid

Chemical & Physical Properties

[ Density]:
1.27g/cm3

[ Boiling Point ]:
396.3ºC at 760mmHg

[ Melting Point ]:
116ºC

[ Molecular Formula ]:
C14H12O2S

[ Molecular Weight ]:
244.30900

[ Flash Point ]:
193.5ºC

[ Exact Mass ]:
244.05600

[ PSA ]:
62.60000

[ LogP ]:
3.46490

[ Vapour Pressure ]:
5.43E-07mmHg at 25°C

[ Index of Refraction ]:
1.656

[ Storage condition ]:
2-8°C

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AJ3262000
CHEMICAL NAME :
Acetic acid, (o-(phenylthio)phenyl)-
CAS REGISTRY NUMBER :
1527-17-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H12-O2-S
MOLECULAR WEIGHT :
244.32
WISWESSER LINE NOTATION :
QV1R BSR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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: 19,798,1976

Safety Information

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Iodophenylacetic acid
  • Thiophenol
  • 2-Methyl diphenyl sulfide
  • 2-phenylthiophenylacetonitrile
  • 2-Iodobenzoic acid
  • (2-phenylsulfanylphenyl)methanol
  • 2-(Phenylsulfanyl)benzoic acid
  • 1-(chloromethyl)-2-phenylsulfanylbenzene
  • 1-(Bromomethyl)-2-(phenylsulfanyl)benzene
  • 2-Phenylthiobenzoesaeureethylester

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%

Related Compounds

  • 2-chloro-(2-(2-phenylthio)phenyl)acetic acid
  • 2-phenyl-(2-(2-phenylthio)phenyl)acetic acid
  • 2-hydroxy-(2-(2-phenylthio)phenyl)acetic acid
  • 2-[2-(phenylcarbamoyl)phenyl]acetic acid
  • 2-(2-(dimethylamino)phenyl)acetic acid
  • 2-(2-(methoxycarbonyl)phenyl)acetic acid
  • N-(2-chlorophenyl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(2-(methylthio)phenyl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(2,5-difluorophenyl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(3-chloro-4-fluorophenyl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(1,3-Benzodioxol-5-yl)-2-phenyl-2-pyrrol-1-ylacetamide
  • 2-phenyl-N-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)acetamide
  • 2-phenyl-2-(1H-pyrrol-1-yl)-N-(thiazol-2-yl)acetamide
  • N-(5-methylisoxazol-3-yl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
  • N-(3-chloro-4-methoxyphenyl)-2-phenyl-2-(1H-pyrrol-1-yl)acetamide
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