Introduction：Basic information about CAS 1153-45-3|Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzenesulfonic acid,4-methyl-, 4-nitrophenyl ester |
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| CAS Number | 1153-45-3 | Molecular Weight | 293.29500 |
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| Density | 1.388g/cm3 | Boiling Point | 469.4ºC at 760mmHg |
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| Molecular Formula | C13H11NO5S | Melting Point | / |
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| MSDS | / | Flash Point | 237.7ºC |
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Names
| Name | (4-nitrophenyl) 4-methylbenzenesulfonate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.388g/cm3 |
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| Boiling Point | 469.4ºC at 760mmHg |
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| Molecular Formula | C13H11NO5S |
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| Molecular Weight | 293.29500 |
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| Flash Point | 237.7ºC |
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| Exact Mass | 293.03600 |
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| PSA | 97.57000 |
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| LogP | 4.27490 |
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| Vapour Pressure | 1.56E-08mmHg at 25°C |
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| Index of Refraction | 1.604 |
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| InChIKey | DOXAGUPGJPEQFP-UHFFFAOYSA-N |
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| SMILES | Cc1ccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2)cc1 |
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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 DATAACUTE 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
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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 |
