Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
3-니트로-4-메톡시벤자닐리드
3-니트로-4-메톡시벤자닐리드 · 4-methoxy-3-nitro-n-phenylbenzamide · 3-nitro-p-anisanilid · 3-NITRO-P-ANISANILIDE · p-Anisanilide, 3-nitro. · 4-methoxy-3-nitro-n-phenyl · 3-Nitro-4-methoxybenzanilide · 4-METHOXY-3-NITROBENZANILIDE
식별자 및 물리적 특성
| CAS No. | 97-32-5 |
|---|---|
| 분자식 | C14H12N2O4 |
| 평균 분자량 | 272.26 g/mol |
| 단동위원소 질량 | 272.07970687 g/mol |
| SMILES | COc1ccc(C(=O)Nc2ccccc2)cc1[N+](=O)[O-] |
| InChIKey | YKOCPBMVMBUTAX-UHFFFAOYSA-N |
| PubChem CID | 7331 |
| ChEMBL | CHEMBL1325964 |
| EC No. | 202-572-9 |
| DTXSID | DTXSID7025558 |
| 현지명 | 3-니트로-4-메톡시벤자닐리드 |
화학 및 물리적 성질
| XLogP | 2.6 |
|---|---|
| 극성 표면적 | 84.2 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 4 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 20 |
| 형식 전하 | 0 |
| 복잡도 | 350 |
| 용해도 | less than 0.1 mg/mL at 59 °F (NTP, 1992) |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Physical Description | 4-methoxy-3-nitro-n-phenylbenzamide is a light tan solid. (NTP, 1992) |
| 끓는 점 | 415.31°C (rough estimate) |
| 밀도 | 1.2499 (rough estimate) |
| 증기압 | 0.001Pa at 20℃ |
| 굴절률 | 1.6180 (estimate) |
| 물리적 상태 | 가루 |
| LogP(분배 계수) | 2.69 at 23℃ and pH7.8-7.9 |
| EPA | 4-Methoxy-3-nitro-N-phenylbenzamide (97-32-5) |
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 2.6% (1 of 39) of reports.WarningH319 (97.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. |
|---|---|
| 규제 정보 | REACH registered substance: 4-methoxy-3-nitro-N-phenylbenzamide (EC: 202-572-9) |
| 화재 위험 | This chemical is probably combustible. (NTP, 1992) |
| 반응성 그룹 | Amides and Imides |
| Reactivity Profile | A nitrated benzamide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx). |
| Air and Water Reactions | This chemical may be sensitive to prolonged exposure to air. (NTP, 1992). Insoluble in water. |
| Hazard Classes and Categories | Eye Irrit. 2 (97.4%) |
| 소화 | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
| 응급 처치 | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
| 비화재 누출 대응 | SMALL SPILLS AND LEAKAGE: You should dampen the solid spill material with acetone, then transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the adsorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. |
용도
일반 설명
Light tan solid.