(3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride

Modify Date: 2025-10-12 02:19:24

(3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride Structure
(3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride structure
 Common Name (3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride
CAS Number 42505-71-5 Molecular Weight 337.93000
Density N/A Boiling Point N/A
Molecular Formula C17H20ClNS2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride

 Chemical & Physical Properties

Molecular Formula C17H20ClNS2
Molecular Weight 337.93000
Exact Mass 337.07300
PSA 56.78000
LogP 5.53920
InChIKey XGNKZQYKUBCFQV-TWNLEINFSA-N
SMILES CN(C)CCC=C1c2ccccc2CSc2ccsc21.Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TX1566000
CHEMICAL NAME :
1-Propanamine, N,N-dimethyl-3-thieno(3,2-c)(2)benzothiepin-10(5H)-yl idene-, hydrochloride
CAS REGISTRY NUMBER :
42505-71-5
LAST UPDATED :
198612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H19-N-S2.Cl-H
MOLECULAR WEIGHT :
337.95

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 :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 40,2905,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
18500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 40,2905,1975
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Chemsrc provides CAS#:42505-71-5 MSDS, density, melting point, boiling point, structure, etc. Its name is (3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride>> amp version: (3E)-N,N-dimethyl-3-(5H-thieno[3,2-c][2]benzothiepin-10-ylidene)propan-1-amine,hydrochloride

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