기본 정보
- CAS
6265-15-2- 표준 SMILES
Cc1cc(NC(=O)c2ccc(N)cc2)cc(C(=O)O)c1O- InChIKey
AOMFEMQHOBBHFK-UHFFFAOYSA-N- 분자식
- C15H14N2O4
- 평균 분자량
- 286.28 g/mol
- 단동위원소 질량
- 286.09535693
이름 및 식별자
- 우선 이름
- 5-(4-Aminobenzamido)-2,3-cresotic acid
- IUPAC
- 5-[(4-aminobenzoyl)amino]-2-hydroxy-3-methylbenzoic acid
이름 및 동의어
5-(4-Aminobenzamido)-2,3-cresotic acid5-[(4-aminobenzoyl)amino]-2-hydroxy-3-methylbenzoic acidDTXSID80748675-((4-Aminobenzoyl)amino)-2-hydroxy-3-methylbenzoic acid2,3-Cresotic acid, 5-(p-aminobenzamido)-RefChem:530149DTXCID70434596265-15-2Benzoic acid, 5-((4-aminobenzoyl)amino)-2-hydroxy-3-methyl-5-(4-Aminobenzamido)-2-hydroxy-3-methylbenzoic acid
데이터베이스 식별자
- CAS
6265-15-2- PubChem CID
- 22640
- DTXSID
DTXSID8074867
물성
구조 계산 물성
- XLogP
- 2.2
- 극성 표면적
- 113 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 393
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Reactive GroupAcids, Carboxylic
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
안전 및 보호
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
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.
Nonfire Spill ResponseSTORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992)
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)
관련 반응
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