(4-nitrophenyl) 4-bromobenzenesulfonate

Modify Date: 2025-09-12 12:34:51

(4-nitrophenyl) 4-bromobenzenesulfonate Structure
(4-nitrophenyl) 4-bromobenzenesulfonate structure
Common Name (4-nitrophenyl) 4-bromobenzenesulfonate
CAS Number 53271-19-5 Molecular Weight 358.16500
Density 1.696g/cm3 Boiling Point 499.4ºC at 760 mmHg
Molecular Formula C12H8BrNO5S Melting Point N/A
MSDS N/A Flash Point 255.8ºC

 Names

Name (4-nitrophenyl) 4-bromobenzenesulfonate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.696g/cm3
Boiling Point 499.4ºC at 760 mmHg
Molecular Formula C12H8BrNO5S
Molecular Weight 358.16500
Flash Point 255.8ºC
Exact Mass 356.93100
PSA 97.57000
LogP 4.72900
Index of Refraction 1.636
InChIKey JTDCQHDVMWJUEB-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(Br)cc2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DB5063000
CHEMICAL NAME :
Benzenesulfonic acid, p-bromo-, p-nitrophenyl ester
CAS REGISTRY NUMBER :
53271-19-5
BEILSTEIN REFERENCE NO. :
2882865
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H8-Br-N-O5-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,21,1953

 Synthetic Route

~%

(4-nitrophenyl) 4-bromobenzenesulfonate Structure

(4-nitrophenyl)...

CAS#:53271-19-5

Learn More
Literature: Sekera Journal of the American Chemical Society, 1933 , vol. 55, p. 421

 Synonyms

4-nitrophenyl 4-bromobenzenesulfonate
p-Nitrophenyl p-bromobenzenesulfonate
Benzenesulfonic acid,p-bromo-,p-nitrophenyl ester
Benzenesulfonic acid,4-bromo-,4-nitrophenyl ester
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