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

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Names

[ CAS No. ]:
1153-45-3

[ Name ]:
Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester

[Synonym ]:
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

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

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-Nitrophenol
  • Tosyl chloride
  • para-Tolyl disulfide
  • thallium(I) 4-nitrophenoxide
  • P-toluenethiol
  • Benzenesulfonic acid,4-methyl-, phenyl ester
  • Phenol
  • Sodium 4-nitrophenoxide

DownStream

  • 1-Bromo-4-nitrobenzene
  • 1-Iodo-4-nitrobenzene
  • 4-Chloronitrobenzene
  • Bis(4-methylbenzenesulfon)amine
  • p-toluenesulfonyl fluoride
  • Phenol, 4-nitro-, ion(1-) (9CI)
  • 4-Nitrophenol
  • N-benzyl-4-nitrobenzenamine
  • BTS
  • p-Toluenesulfonic acid

Related Compounds

  • 3-Bromo-2-hydroxycyclohexan-1-one
  • N'-(2-aminophenyl)-N-[3-(trifluoromethyl)phenyl]heptanediamide
  • 2-[(Oxetan-3-yl)amino]propanoic acid
  • 2-[2-(3-Thienyl)ethylidene]hydrazinecarboxamide
  • 2-Methyl-1-(thiophen-2-yl)cyclopropan-1-amine
  • 1-(3-Hydroxy-1,4-dioxan-2-yl)-2-propanone
  • Methyl 3-(5-(2-(benzyloxy)-2-oxoethyl)benzofuran-2-yl)picolinate
  • 1-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2,2,2-trifluoroethan-1-ol
  • 1,4-Ethanoanthracen-9,10-imine, 11-chloro-1,4,4a,9,9a,10-hexahydro-, (1I+/-,4I+/-,4aI+/-,9I(2),9aI+/-,10I(2))-
  • (1-Ethylidene-3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)phenylmethanone
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