Introduction：Basic information about CAS 99-77-4|Ethyl 4-nitrobenzoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ethyl 4-nitrobenzoate |
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| CAS Number | 99-77-4 | Molecular Weight | 195.172 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 315.0±25.0 °C at 760 mmHg |
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| Molecular Formula | C9H9NO4 | Melting Point | 55-59 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 148.2±25.2 °C |
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Names
| Name | Ethyl p-nitrobenzoate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 315.0±25.0 °C at 760 mmHg |
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| Melting Point | 55-59 °C(lit.) |
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| Molecular Formula | C9H9NO4 |
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| Molecular Weight | 195.172 |
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| Flash Point | 148.2±25.2 °C |
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| Exact Mass | 195.053162 |
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| PSA | 72.12000 |
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| LogP | 2.33 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.545 |
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| InChIKey | PHWSCBWNPZDYRI-UHFFFAOYSA-N |
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| SMILES | CCOC(=O)c1ccc([N+](=O)[O-])cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH5600000
- CHEMICAL NAME :
- Benzoic acid, p-nitro-, ethyl ester
- CAS REGISTRY NUMBER :
- 99-77-4
- BEILSTEIN REFERENCE NO. :
- 1912879
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H9-N-O4
- MOLECULAR WEIGHT :
- 195.19
- WISWESSER LINE NOTATION :
- WNR DVO2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 250 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Hazard Codes | Xi |
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| Risk Phrases | R33 |
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| Safety Phrases | S22-S24/25 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 3 |
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| RTECS | DH5600000 |
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| HS Code | 2916399090 |
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Customs
| HS Code | 2916399090 |
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| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| Ethyl para-nitrobenzoate |
| 4-Nitrobenzoic acid ethyl ester |
| Benzoic acid, 4-nitro-, ethyl ester |
| ethyl p-nitrobenzoate |
| MFCD00007351 |
| ethyl 4-nitrobenzoate |
| EINECS 202-786-2 |
