CAS 1154-12-7|(dimethyl)[3-thieno[2,3-c][2]benzothiepin-4(9H)-ylidenepropyl]ammonium chloride

Introduction：Basic information about CAS 1154-12-7|(dimethyl)[3-thieno[2,3-c][2]benzothiepin-4(9H)-ylidenepropyl]ammonium chloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Synonyms

Common Name	(dimethyl)[3-thieno[2,3-c][2]benzothiepin-4(9H)-ylidenepropyl]ammonium chloride
CAS Number	1154-12-7	Molecular Weight	337.930
Density	1.221g/cm3	Boiling Point	436.2ºC at 760mmHg
Molecular Formula	C₁₇H₂₀ClNS₂	Melting Point	/
MSDS	/	Flash Point	217.6ºC

Names

Name	(dimethyl)[3-thieno[2,3-c][2]benzothiepin-4(9H)-ylidenepropyl]ammonium chloride
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.221g/cm3
Boiling Point	436.2ºC at 760mmHg
Molecular Formula	C₁₇H₂₀ClNS₂
Molecular Weight	337.930
Flash Point	217.6ºC
Exact Mass	337.072571
PSA	57.98000
LogP	0.32410
InChIKey	KTFGSVWWMYCIJB-UHFFFAOYSA-N
SMILES	CN(C)CCC=C1c2ccccc2CSc2sccc21.Cl

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DL8400000

CHEMICAL NAME :: Benzo(e)thieno(2,3-b)thiepin, 4,9-dihydro-4-(3-dimethylaminopropylidene)-, hydrochloride

CAS REGISTRY NUMBER :: 1154-12-7

LAST UPDATED :: 199706

DATA ITEMS CITED :: 6

MOLECULAR FORMULA :: C17-H19-N-S2.Cl-H

MOLECULAR WEIGHT :: 337.95

WISWESSER LINE NOTATION :: T B656 AS CS FH KHJ K3N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 663 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 15200 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 183 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 31700 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 477 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 25400 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CKFRAY Ceskoslovenska Farmacie. (PNS-Ustredni Expedice a Dovoz Tisku, Kafkova 19, 160 00 Prague 6, Czechoslovakia) V.1- 1952- Volume(issue)/page/year: 41,185,1992

Synonyms

4-(3-Dimethylaminopropyliden)-4,9-dihydrothieno(2,3-B)benzo(E)thiepin hydrochlorid

1-Propanamine, N,N-dimethyl-3-thieno[2,3-c][2]benzothiepin-4(9H)-ylidene-, (3E)-, hydrochloride (1:1)

Benzo(E)thieno(2,3-B)thiepin,4,9-dihydro-4-(3-dimethylaminopropylidene)-,hydrochloride

4-(3-Dimethylaminopropylidene)-4,9-dihydrobenzo(E)thieno(2,3-B)thiepin hydrochloride

N,N-dimethyl-3-thien

(3E)-N,N-Dimethyl-3-(thieno[2,3-c][2]benzothiepin-4(9H)-ylidene)-1-propanamine hydrochloride (1:1)

4-(3-Dimethylaminopropyliden)-4,9-dihydrothieno(2,3-B)benzo(E)thiepin hydrochlorid [german]

Dithiaden hydrochloride

Dithiadene hydrochloride

Recommended......