Introduction:Basic information about CAS 115873-09-1|4-[2-(4-carboxy-3-nitrophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-nitrobenzoic aci, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-[2-(4-carboxy-3-nitrophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-nitrobenzoic acid |
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| CAS Number | 115873-09-1 | Molecular Weight | 482.24400 |
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| Density | 1.696g/cm3 | Boiling Point | 512.5ºC at 760mmHg |
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| Molecular Formula | C17H8F6N2O8 | Melting Point | / |
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| MSDS | / | Flash Point | 263.8ºC |
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Names
| Name | 4-[2-(4-carboxy-3-nitrophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-nitrobenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.696g/cm3 |
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| Boiling Point | 512.5ºC at 760mmHg |
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| Molecular Formula | C17H8F6N2O8 |
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| Molecular Weight | 482.24400 |
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| Flash Point | 263.8ºC |
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| Exact Mass | 482.01800 |
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| PSA | 166.24000 |
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| LogP | 5.35650 |
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| Vapour Pressure | 2.5E-11mmHg at 25°C |
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| Index of Refraction | 1.562 |
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| InChIKey | HTFPTCABXGMXOB-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1ccc(C(c2ccc(C(=O)O)c([N+](=O)[O-])c2)(C(F)(F)F)C(F)(F)F)cc1[N+](=O)[O-] |
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Safety Information
| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | R36/38 |
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| Safety Phrases | S22 |
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Synonyms
| PC2193 |
| 2,2-bis-(4-carboxy-3-nitrophenyl)-hexafluoropropane |
| Benzoic acid,4,4'-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis[2-nitro-(9CI) |
| 2,2,7-TRIMETHYL-2H-PYRANO[4,3-B]PYRAN-5-ONE |