Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride

Modify Date: 2025-09-28 11:42:00

Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride Structure
Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride structure
Common Name Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride
CAS Number 7349-45-3 Molecular Weight 290.25200
Density 1.185g/cm3 Boiling Point 321.9ºC at 760 mmHg
Molecular Formula C13H17Cl2NS Melting Point N/A
MSDS N/A Flash Point 148.5ºC

 Names

Name Benzo[b]thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.185g/cm3
Boiling Point 321.9ºC at 760 mmHg
Molecular Formula C13H17Cl2NS
Molecular Weight 290.25200
Flash Point 148.5ºC
Exact Mass 289.04600
PSA 31.48000
LogP 4.76400
Index of Refraction 1.613
InChIKey SHJSEQUNRLPPOL-UHFFFAOYSA-N
SMILES CC[NH+](CCCl)Cc1csc2ccccc12.[Cl-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DL9699000
CHEMICAL NAME :
Benzo(b)thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
CAS REGISTRY NUMBER :
7349-45-3
LAST UPDATED :
199009
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H16-Cl-N-S.Cl-H
MOLECULAR WEIGHT :
290.27
WISWESSER LINE NOTATION :
T56 BSJ D1N2&2G &GH

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 :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 9,819,1966

 Synthetic Route

~%

Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride Structure

Benzo[b]thiophe...

CAS#:7349-45-3

Literature: Nation. Drug. Co. Patent: US2553495 , 1950 ;

~%

Benzo[b]thiophene-3-methanamine, N- (2-chloroethyl)-N-ethyl-, hydrochloride Structure

Benzo[b]thiophe...

CAS#:7349-45-3

Literature: Nation. Drug. Co. Patent: US2553495 , 1950 ;

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

SY 2
Aethyl-benzo[b]thiophen-3-ylmethyl-(2-chlor-aethyl)-amin,Hydrochlorid
N-(2-Chloroethyl)-N-ethyldiphenylmethylamine
ethyl-benzhydryl-(2-chloro-ethyl)-amine,hydrochloride
Aethyl-benzhydryl-(2-chlor-aethyl)-amin,Hydrochlorid
Diethylamine,2-chloro-N-(diphenylmethyl)-,hydrochloride
ethyl-benzo[b]thiophen-3-ylmethyl-(2-chloro-ethyl)-amine,hydrochloride
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