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42780-21-2

42780-21-2 structure

42780-21-2 structure

Name: 2-(1-benzhydryl-2,5-dimethylpyrrol-3-yl)acetic acid
Chemical Name: 2-(1-benzhydryl-2,5-dimethylpyrrol-3-yl)acetic acid
CAS Number: 42780-21-2
Molecular Formula: C₂₁H₂₁NO₂
Molecular Weight: 319.39700
Create Date: 2016-06-14 23:24:05
Modify Date: 2025-08-25 11:11:43

Name	2-(1-benzhydryl-2,5-dimethylpyrrol-3-yl)acetic acid

Molecular Formula	C₂₁H₂₁NO₂
Molecular Weight	319.39700
Exact Mass	319.15700
PSA	42.23000
LogP	4.36970

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UX9278750

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

CAS REGISTRY NUMBER :: 42780-21-2

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C21-H21-N-O2

MOLECULAR WEIGHT :: 319.43

WISWESSER LINE NOTATION :: T5NJ AYR&R& 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 :: 2450 mg/kg

TOXIC EFFECTS :: 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

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