Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester

Modify Date: 2024-01-05 20:26:33

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure
Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester structure
 Common Name Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester
CAS Number 1153-45-3 Molecular Weight 293.29500
Density 1.388g/cm3 Boiling Point 469.4ºC at 760mmHg
Molecular Formula C13H11NO5S Melting Point N/A
MSDS N/A Flash Point 237.7ºC

 Names

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

 Chemical & Physical Properties

Density 1.388g/cm3
Boiling Point 469.4ºC at 760mmHg
Molecular Formula C13H11NO5S
Molecular Weight 293.29500
Flash Point 237.7ºC
Exact Mass 293.03600
PSA 97.57000
LogP 4.27490
Vapour Pressure 1.56E-08mmHg at 25°C
Index of Refraction 1.604

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XT7130020
CHEMICAL NAME :
p-Toluenesulfonic acid, p-nitrophenyl ester
CAS REGISTRY NUMBER :
1153-45-3
BEILSTEIN REFERENCE NO. :
2390365
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H11-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: 5,34,1953

 Synthetic Route

4-Nitrophenol structure

4-Nitrophenol

CAS#:100-02-7
Tosyl chloride structure

Tosyl chloride

CAS#:98-59-9

~99%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Dainippon Sumitomo Pharma Co., Ltd. Patent: EP1844768 A1, 2007 ; Location in patent: Page/Page column 34 ;
4-Nitrophenol structure

4-Nitrophenol

CAS#:100-02-7
para-Tolyl disulfide structure

para-Tolyl disulfide

CAS#:103-19-5

~89%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Veisi, Hojat; Ataee, Meral; Fatolahi, Leila; Lotfi, Shahram Letters in Organic Chemistry, 2013 , vol. 10, # 2 p. 111 - 117
thallium(I) 4-nitrophenoxide structure

thallium(I) 4-n...

CAS#:32707-03-2
Tosyl chloride structure

Tosyl chloride

CAS#:98-59-9

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Taylor,E.C. et al. Journal of the American Chemical Society, 1968 , vol. 90, p. 2422 - 2423
P-toluenethiol structure

P-toluenethiol

CAS#:106-45-6

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Hemmati, Saba; Mojtahedi, Mohammad Majid; Abaee, Mohammad Saeed; Vafajoo, Zahra; Saremi, Shokufe Ghahri; Noroozi, Mohammad; Sedrpoushan, Alireza; Ataee, Meral Journal of Sulfur Chemistry, 2013 , vol. 34, # 4 p. 347 - 357
para-Tolyl disulfide structure

para-Tolyl disulfide

CAS#:103-19-5

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Hemmati, Saba; Mojtahedi, Mohammad Majid; Abaee, Mohammad Saeed; Vafajoo, Zahra; Saremi, Shokufe Ghahri; Noroozi, Mohammad; Sedrpoushan, Alireza; Ataee, Meral Journal of Sulfur Chemistry, 2013 , vol. 34, # 4 p. 347 - 357
Benzenesulfonic acid,4-methyl-, phenyl ester structure

Benzenesulfonic...

CAS#:640-60-8

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Reverdin; Crepieux Bulletin de la Societe Chimique de France, 1902 , vol. <3>27, p. 745,746 Chemische Berichte, 1902 , vol. 35, p. 1444
Phenol structure

Phenol

CAS#:108-95-2

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Reverdin; Crepieux Bulletin de la Societe Chimique de France, 1902 , vol. <3>27, p. 745,746 Chemische Berichte, 1902 , vol. 35, p. 1444
Tosyl chloride structure

Tosyl chloride

CAS#:98-59-9
Sodium 4-nitrophenoxide structure

Sodium 4-nitrop...

CAS#:824-78-2

~%

Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester Structure

Benzenesulfonic...

CAS#:1153-45-3
Literature: Bamberger; Rising Chemische Berichte, 1901 , vol. 34, p. 228

 Synonyms

Benzenesulfonic acid,4-methyl-,4-nitrophenyl ester
p-Toluenesulfonic acid,p-nitrophenyl ester
p-Nitrophenyl tosylate
4-nitrophenyl 4-methylbenzenesulfonate
Phenol,p-nitro-,p-toluenesulfonate
4-nitrophenyl p-toluenesulfonate
4-Nitrophenyl 4-toluenesulfonate
p-nitrophenyl p-toluene sulfonate
p-nitrophenyl p-toluenesulphonate
4-Nitrophenyl tosylate
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