42780-31-4

42780-31-4 structure

42780-31-4 structure

Name: 2-[1-(2,3-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
Chemical Name: 2-[1-(2,3-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
CAS Number: 42780-31-4
Molecular Formula: C₁₄H₁₃Cl₂NO₂
Molecular Weight: 298.16500
Create Date: 2017-10-29 21:42:32
Modify Date: 2024-01-05 09:28:15

Name	2-[1-(2,3-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid

Molecular Formula	C₁₄H₁₃Cl₂NO₂
Molecular Weight	298.16500
Exact Mass	297.03200
PSA	42.23000
LogP	4.02800

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UX9277980

CHEMICAL NAME :: 1H-Pyrrole-3-acetic acid, 1-(2,3-dichlorophenyl)-2,5-dimethyl-

CAS REGISTRY NUMBER :: 42780-31-4

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H13-Cl2-N-O2

MOLECULAR WEIGHT :: 298.18

WISWESSER LINE NOTATION :: T5NJ AR BG CG& B1 C1VQ E1

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 :: 1 gm/kg

TOXIC EFFECTS :: Behavioral - analgesia Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation

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