기본 정보
- CAS
68155-71-5- 표준 SMILES
COc1ccccc1NC(=O)C(N=Nc1ccc(NC(=O)c2ccc(N=NC(C(C)=O)C(=O)Nc3ccccc3OC)cc2)cc1)C(C)=O- InChIKey
NWOKKZCOSYPGDQ-UHFFFAOYSA-N- 분자식
- C35H33N7O7
- 평균 분자량
- 663.7 g/mol
- 단동위원소 질량
- 663.24414642
이름 및 식별자
- 우선 이름
- Benzamide, 4-(1-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)-N-(4-(1-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)phenyl)-
- IUPAC
- 4-[[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]benzamide
- 영어명
- 4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]benzamide
- 분자식
- C35H33N7O7
- 분자량
- 663.68
이름 및 동의어
EINECS 268-984-6Benzamide, 4-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)-N-(4-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)-Benzamide, 4-(1-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)-N-(4-(1-(1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)diazenyl)phenyl)-Benzamide, 4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-Benzamide, 4-[1-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-N-[4-[1-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]phenyl]-RefChem:56145568155-71-5NWOKKZCOSYPGDQ-UHFFFAOYSA-NDTXSID701100438NS000630914-((1-(((2-Methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)-N-(4-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)benzamide4-[1-[1-[[(2-Methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-N-[4-[1-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]phenyl]benzamide
이름 더 보기
4-[1-[[(2-Methoxyphenyl)amino]carbonyl]-2-oxopropylazo]-N-[4-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropylazo]phenyl]benzamide4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]benzamide
데이터베이스 식별자
- CAS
68155-71-5- PubChem CID
- 109669
- DTXSID
DTXSID701100438- EC Number
- 268-984-6
- Nikkaji
- J317.372K
물성
구조 계산 물성
- XLogP
- 6
- 극성 표면적
- 189 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 49
- 형식 전하
- 0
- 복잡도
- 1,200
물리화학적 성질
- 끓는 점
- 759.14 · 759.140±60.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.303 · 1.303±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 8.359 · 8.359±0.59(predicted)
- EPA
- 4 · Benzamide, 4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]- (68155-71-5)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzamide, 4-[1-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-N-[4-[1-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]phenyl]-: INACTIVE
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