기본 정보
- CAS
16421-41-3- 표준 SMILES
COc1cc(N=Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(NC(C)=O)cc1N(CCOC(C)=O)Cc1ccccc1- InChIKey
JNVFJTYCXXHXEF-UHFFFAOYSA-N- 분자식
- C26H26N6O8
- 평균 분자량
- 550.5 g/mol
- 단동위원소 질량
- 550.18121181
이름 및 식별자
- 우선 이름
- Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[2-(2,4-dinitrophenyl)diazenyl]-4-methoxyphenyl]-
- IUPAC
- 2-[5-acetamido-N-benzyl-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxyanilino]ethyl acetate
- 영어명
- 2-[[5-acetamido-4-[(2,4-dinitrophenyl)azo]-2-methoxyphenyl]benzylamino]ethyl acetate
- 분자식
- C26H26N6O8
- 분자량
- 550.52
이름 및 동의어
EINECS 240-471-1Acetamide, N-(5-((2-(acetyloxy)ethyl)(phenylmethyl)amino)-2-((2,4-dinitrophenyl)azo)-4-methoxyphenyl)-Acetamide, N-(5-((2-(acetyloxy)ethyl)(phenylmethyl)amino)-2-(2-(2,4-dinitrophenyl)diazenyl)-4-methoxyphenyl)-Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2,4-dinitrophenyl)azo]-4-methoxyphenyl]-Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[2-(2,4-dinitrophenyl)diazenyl]-4-methoxyphenyl]-RefChem:551745Acetamide, N-5-2-(acetyloxy)ethyl(phenylmethyl)amino-2-(2,4-dinitrophenyl)azo-4-methoxyphenyl-16421-41-32-((5-Acetamido-4-((2,4-dinitrophenyl)azo)-2-methoxyphenyl)benzylamino)ethyl acetate2-[[5-acetamido-4-[(2,4-dinitrophenyl)azo]-2-methoxyphenyl]benzylamino]ethyl acetateJNVFJTYCXXHXEF-UHFFFAOYSA-N2-[5-acetamido-N-benzyl-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxyanilino]ethyl acetate
이름 더 보기
N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2,4-dinitrophenyl)azo]-4-methoxyphenyl]-Acetamide
DTXSID8066050NS000201572-[{5-Acetamido-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxyphenyl}(benzyl)amino]ethyl acetate
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 184 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 903
물리화학적 성질
- 끓는 점
- 789.5 · 789.5±60.0 °C(Predicted)
- 밀도
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.43 · 13.43±0.70(Predicted)
- EPA
- 5 · Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2,4-dinitrophenyl)azo]-4-methoxyphenyl]- (16421-41-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Chemical: Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2,4-dinitrophenyl)azo]-4-methoxyphenyl]-
Hazard Traits - Bioaccumulation; Environmental Persistence
Acetamide, N-5-2-(acetyloxy)ethyl(phenylmethyl)amino-2-(2,4-dinitrophenyl)azo-4-methoxyphenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - Acetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[(2,4-dinitrophenyl)azo]-4-methoxyphenyl]-: Human health tier I assessment
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationAcetamide, N-[5-[[2-(acetyloxy)ethyl](phenylmethyl)amino]-2-[2-(2,4-dinitrophenyl)diazenyl]-4-methoxyphenyl]-: ACTIVE
공급사1 곳
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