식별자 및 물리적 특성
| CAS No. | 6265-13-0 |
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| 분자식 | C8H11NO |
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| 평균 분자량 | 137.18 g/mol |
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| 단동위원소 질량 | 137.08406397 g/mol |
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| SMILES | CNc1cc(O)ccc1C |
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| InChIKey | QQOKUOJOGXTCMN-UHFFFAOYSA-N |
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| PubChem CID | 22639 |
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| DTXSID | DTXSID3074866 |
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화학 및 물리적 성질
| XLogP | 1.9 |
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| 극성 표면적 | 32.3 |
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| 수소 결합 공여자 수 | 2 |
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| 수소 결합 수용자 수 | 2 |
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| 회전 가능 결합 수 | 1 |
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| 무거운 원자 수 | 10 |
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| 형식 전하 | 0 |
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| 복잡도 | 105 |
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| Physical Description | 3-methylamino-4-methylphenol is a crystalline solid. |
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| 끓는 점 | 281.4±28.0 °C(Predicted) |
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| 밀도 | 1.109±0.06 g/cm3(Predicted) |
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| 저장 조건 | 2-8°C, protect from light, stored under nitrogen |
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| pKa(산도 계수) | 10.44±0.18(Predicted) |
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| EPA | 3-(Methylamino)-4-methylphenol (6265-13-0) |
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안전 및 규제
| 화재 위험 | Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992) |
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| 반응성 그룹 | Amines, Phosphines, and Pyridines |
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| Reactivity Profile | Phenols, such as 3-METHYLAMINO-4-METHYLPHENOL, do not behave as organic alcohols, as one might guess from the presence of a hydroxyl (-OH) group in their structure. Instead, they react as weak organic acids. Phenols and cresols are much weaker as acids than common carboxylic acids (phenol has pKa = 9.88). These materials are incompatible with strong reducing substances such as hydrides, nitrides, alkali metals, and sulfides. Flammable gas (H2) is often generated, and the heat of the reaction may ignite the gas. Heat is also generated by the acid-base reaction between phenols and bases. Such heating may initiate polymerization of the organic compound. Phenols are sulfonated very readily (for example, by concentrated sulfuric acid at room temperature). The reactions generate heat. Phenols are also nitrated very rapidly, even by dilute nitric acid. |
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| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
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| 소화 | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
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| 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. |
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| 비화재 누출 대응 | STORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992) |
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| Personal Protective Equipment (PPE) | RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992) |
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| 신호 어 | Warning |
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| 유해·위험 문구 | 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H315 |
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