ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Modify Date: 2025-08-28 18:09:17

ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure	Common Name	ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
	CAS Number	76981-73-2	Molecular Weight	281.37100
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₄H₁₉NO₃S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Molecular Formula	C₁₄H₁₉NO₃S
Molecular Weight	281.37100
Exact Mass	281.10900
PSA	87.13000
LogP	3.65750
InChIKey	MMOGJFVKKPVAKG-UHFFFAOYSA-N
SMILES	CCOC(=O)c1c(NC(C)=O)sc2c1CCC(C)C2

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DL9603620

CHEMICAL NAME :: Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(acetylamino)-6-methyl-, ethyl ester

CAS REGISTRY NUMBER :: 76981-73-2

LAST UPDATED :: 199712

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H19-N-O3-S

MOLECULAR WEIGHT :: 281.40

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1 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: 15,413,1980

HS Code	2934999090

Precursor 0
DownStream 1
CAS#:120354-21-4 3-METHOXY-4-PYR...

HS Code	2934999090
Summary	2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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