5-acetyloxy-2,3-dimethyl-1-benzofuran-6-carboxylic acid

Modify Date: 2025-09-21 21:01:57

5-acetyloxy-2,3-dimethyl-1-benzofuran-6-carboxylic acid structure	Common Name	5-acetyloxy-2,3-dimethyl-1-benzofuran-6-carboxylic acid
	CAS Number	71590-89-1	Molecular Weight	248.23100
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₃H₁₂O₅	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	5-acetyloxy-2,3-dimethyl-1-benzofuran-6-carboxylic acid
Synonym	More Synonyms

Molecular Formula	C₁₃H₁₂O₅
Molecular Weight	248.23100
Exact Mass	248.06800
PSA	76.74000
LogP	2.67310
InChIKey	FFHJYGXUEYWDNO-UHFFFAOYSA-N
SMILES	CC(=O)Oc1cc2c(C)c(C)oc2cc1C(=O)O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DF6493000

CHEMICAL NAME :: 6-Benzofurancarboxylic acid, 2,3-dimethyl-5-hydroxy-, acetate

CAS REGISTRY NUMBER :: 71590-89-1

BEILSTEIN REFERENCE NO. :: 1387909

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H12-O5

MOLECULAR WEIGHT :: 248.25

WISWESSER LINE NOTATION :: T56 BOJ C1 D1 GOV1 HVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 550 mg/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: 14,223,1979

2,3-Dimethyl-5-hydroxy-6-benzofurancarboxylic acid acetate

6-BENZOFURANCARBOXYLIC ACID,2,3-DIMETHYL-5-HYDROXY-,ACETATE

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