2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one

Modify Date: 2024-01-10 19:58:34

2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one Structure
2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one structure
Common Name 2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one
CAS Number 81744-01-6 Molecular Weight 290.17600
Density N/A Boiling Point 487.8ºC at 760 mmHg
Molecular Formula C13H9NO2Se Melting Point N/A
MSDS N/A Flash Point 248.8ºC

 Names

Name 2-(4-hydroxyphenyl)-1,2-benzoselenazol-3-one

 Chemical & Physical Properties

Boiling Point 487.8ºC at 760 mmHg
Molecular Formula C13H9NO2Se
Molecular Weight 290.17600
Flash Point 248.8ºC
Exact Mass 290.98000
PSA 42.23000
LogP 1.75330

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE4140728
CHEMICAL NAME :
1,2-Benzisoselenazol-3(2H)-one, 2-(4-hydroxyphenyl)-
CAS REGISTRY NUMBER :
81744-01-6
LAST UPDATED :
199803
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C13-H9-N-O2-Se
MOLECULAR WEIGHT :
290.19

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EPXXDW European Patent Application. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #44453
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EPXXDW European Patent Application. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #44453

 Synthetic Route

~99%

2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one Structure

2-(4-Hydroxyphe...

CAS#:81744-01-6

Literature: Medical Research Council; University of Otago Patent: US2004/29851 A1, 2004 ; Location in patent: Page/Page column 9-11 ;

~93%

2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one Structure

2-(4-Hydroxyphe...

CAS#:81744-01-6

Literature: Osajda, Mariusz; Mlochowski, Jacek Tetrahedron, 2002 , vol. 58, # 37 p. 7531 - 7537

~%

2-(4-Hydroxyphenyl)-1,2-benzisoselenazol-3(2H)-one Structure

2-(4-Hydroxyphe...

CAS#:81744-01-6

Literature: Bhabak, Krishna P.; Mugesh, Govindasamy Chemistry - A European Journal, 2007 , vol. 13, # 16 p. 4594 - 4601