1-(4-CHLOROPHENYL)-2-(METHYLSULFONYL)ETHANONE

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Names

[ CAS No. ]:
60217-76-7

[ Name ]:
1-(4-CHLOROPHENYL)-2-(METHYLSULFONYL)ETHANONE

[Synonym ]:
1H-Pyrrole-3-carboxylic acid,1-(4-chlorophenyl)-2,5-dimethyl
1-(4-chlorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid
1-(4-Chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

Chemical & Physical Properties

[ Density]:
1.26g/cm3

[ Boiling Point ]:
414.9ºC at 760 mmHg

[ Molecular Formula ]:
C13H12ClNO2

[ Molecular Weight ]:
249.69300

[ Flash Point ]:
204.7ºC

[ Exact Mass ]:
249.05600

[ PSA ]:
42.23000

[ LogP ]:
3.44570

[ Index of Refraction ]:
1.595

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UX9371340
CHEMICAL NAME :
1H-Pyrrole-3-carboxylic acid, 1-(4-chlorophenyl)-2,5-dimethyl-
CAS REGISTRY NUMBER :
60217-76-7
BEILSTEIN REFERENCE NO. :
0405709
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H12-Cl-N-O2
MOLECULAR WEIGHT :
249.71

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 11,173,1976

Safety Information

[ HS Code ]:
2933990090

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 1-(4-chlorophenyl)-2-methylsulfanylethanone
  • 1-(4-chlorophenyl)-2-cyclooctylethanone
  • 1-(4-chlorophenyl)-2-triphenylphosphoranylidene-ethanone
  • 1-(4-chlorophenyl)-2-cyclopentylethanone
  • 1-(4-chlorophenyl)-2-propylsulfanylethanone
  • 1-(4-chlorophenyl)-2-(methylamino)ethanone
  • (1S)-1-(6-Bromo-3,4-dimethoxy-2-nitrophenyl)-1,2-ethanediamine
  • 1,2-Dihydro-1-methyl-2-[(phenylamino)methylene]-3H-indol-3-one
  • 3-Pyridinyl[3-(2H-tetrazol-5-ylmethyl)-1H-indol-1-yl]methanone
  • Benzenemethanamine, I+/--ethenyl-4-[(4-nitrophenyl)amino]-, (I+/-R)-
  • N,N-Diethyl-3-(1-phenyl-2-propen-1-yl)-1H-indole-1-carboxamide
  • Oxiranebutanoic acid, 3-(2-oxoethyl)-, methyl ester, (2S-cis)-
  • 6-Chloro-N2-(1H-pyrazol-3-ylmethyl)-1,3,5-triazine-2,4-diamine
  • Benzenepropanoic acid, 2-chloro-6-(cyanomethyl)-, methyl ester
  • 3-[(2,2-Dimethoxyethyl)amino]-6-methyl-1,2,4-triazin-5(2H)-one
  • 1,2,3,4-Tetrahydro-1-(phenylmethyl)-5-(1-pyrrolidinyl)pyridine
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