42780-00-7

42780-00-7 structure

42780-00-7 structure

Name: 2-[1-(3-chloro-4-methylphenyl)-2-methyl-5-phenylpyrrol-3-yl]acetic acid
Chemical Name: 2-[1-(3-chloro-4-methylphenyl)-2-methyl-5-phenylpyrrol-3-yl]acetic acid
CAS Number: 42780-00-7
Molecular Formula: C₂₀H₁₈ClNO₂
Molecular Weight: 339.81500
Create Date: 2017-06-20 18:25:17
Modify Date: 2024-02-25 18:57:30

Name	2-[1-(3-chloro-4-methylphenyl)-2-methyl-5-phenylpyrrol-3-yl]acetic acid

Molecular Formula	C₂₀H₁₈ClNO₂
Molecular Weight	339.81500
Exact Mass	339.10300
PSA	42.23000
LogP	5.04160

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UX9277370

CHEMICAL NAME :: 1H-Pyrrole-3-acetic acid, 1-(3-chloro-4-methylphenyl)-2-methyl-5-phenyl-

CAS REGISTRY NUMBER :: 42780-00-7

BEILSTEIN REFERENCE NO. :: 0435618

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C20-H18-Cl-N-O2

MOLECULAR WEIGHT :: 339.84

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 :: >4 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