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

Modify Date: 2024-02-05 07:42:50

1-(4-CHLOROPHENYL)-2-(METHYLSULFONYL)ETHANONE Structure
1-(4-CHLOROPHENYL)-2-(METHYLSULFONYL)ETHANONE structure
Common Name 1-(4-CHLOROPHENYL)-2-(METHYLSULFONYL)ETHANONE
CAS Number 60217-76-7 Molecular Weight 249.69300
Density 1.26g/cm3 Boiling Point 414.9ºC at 760 mmHg
Molecular Formula C13H12ClNO2 Melting Point N/A
MSDS N/A Flash Point 204.7ºC

 Names

Name 1-(4-chlorophenyl)-2,5-dimethylpyrrole-3-carboxylic acid
Synonym More Synonyms

 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%

 Synonyms

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