2(3H)-Benzothiazolone,3-(2-chloroethyl)-

Modify Date: 2025-09-18 12:37:49

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure
2(3H)-Benzothiazolone,3-(2-chloroethyl)- structure
Common Name 2(3H)-Benzothiazolone,3-(2-chloroethyl)-
CAS Number 22258-71-5 Molecular Weight 213.68400
Density 1.382g/cm3 Boiling Point 355ºC at 760mmHg
Molecular Formula C9H8ClNOS Melting Point N/A
MSDS N/A Flash Point 168.5ºC

 Names

Name 3-(2-chloroethyl)-1,3-benzothiazol-2-one

 Chemical & Physical Properties

Density 1.382g/cm3
Boiling Point 355ºC at 760mmHg
Molecular Formula C9H8ClNOS
Molecular Weight 213.68400
Flash Point 168.5ºC
Exact Mass 213.00200
PSA 50.24000
LogP 2.30180
Vapour Pressure 3.22E-05mmHg at 25°C
Index of Refraction 1.633
InChIKey VZRAYMNDMPDPBO-UHFFFAOYSA-N
SMILES O=c1sc2ccccc2n1CCCl

 Synthetic Route

~52%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Kelly, Nicholas Michael; Koch, Kristian Norup; Tolf, Bo-Ragnar Patent: US2004/67931 A1, 2004 ; Location in patent: Page/Page column 19 ;

~%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Zhao, He; Thurkauf, Andrew; He, Xiaoshu; Hodgetts, Kevin; Zhang, Xiaoyan; Rachwal, Stanislaw; Kover, Renata X.; Hutchison, Alan; Peterson, John; Kieltyka, Andrzej; Brodbeck, Robbin; Primus, Renee; Wasley, Jan W.F. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 21 p. 3105 - 3109

~%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Ambartsumova, R. F. Russian Journal of Organic Chemistry, 1993 , vol. 29, # 11.2 p. 1932 - 1933 Zhurnal Organicheskoi Khimii, 1993 , vol. 29, # 11 p. 2320 - 2321

~77%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Ambartsumova, R. F. Russian Journal of Organic Chemistry, 1993 , vol. 29, # 11.2 p. 1932 - 1933 Zhurnal Organicheskoi Khimii, 1993 , vol. 29, # 11 p. 2320 - 2321

~%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Ambartsumova, R. F. Russian Journal of Organic Chemistry, 1993 , vol. 29, # 11.2 p. 1932 - 1933 Zhurnal Organicheskoi Khimii, 1993 , vol. 29, # 11 p. 2320 - 2321

~%

2(3H)-Benzothiazolone,3-(2-chloroethyl)- Structure

2(3H)-Benzothia...

CAS#:22258-71-5

Literature: Ambartsumova, R. F. Russian Journal of Organic Chemistry, 1993 , vol. 29, # 11.2 p. 1932 - 1933 Zhurnal Organicheskoi Khimii, 1993 , vol. 29, # 11 p. 2320 - 2321
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