N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)acrylamide
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기본 정보
- CAS
100098-62-2- 표준 SMILES
CC(C)(CO)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1- InChIKey
KVAFTQANPIPGOD-VOTSOKGWSA-N- 분자식
- C13H16N2O4
- 평균 분자량
- 264.28 g/mol
이름 및 식별자
- 우선 이름
- N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)acrylamide
- IUPAC
- (E)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(3-nitrophenyl)prop-2-enamide
- 영어명
- (E)-N-(2-hydroxy-1,1-dimethyl-ethyl)-3-(3-nitrophenyl)acrylamide
- 분자식
- C13H16N2O4
- 분자량
- 264.28
이름 및 동의어
100098-62-2N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)acrylamide(2E)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(3-nitrophenyl)prop-2-enamideMFCD03871981(E)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(3-nitrophenyl)prop-2-enamide2-propenamide, N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)-, (2E)-ALBB-027494STK217334AKOS002264127LS-09479ST50166704H43553
이름 더 보기
N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)prop-2-enamide(E)-N-(2-hydroxy-1,1-dimethyl-ethyl)-3-(3-nitrophenyl)acrylamideN-(2-hydroxy-1,1-dimethyl-ethyl)-3-(3-nitrophenyl)prop-2-enamideN-(1-hydroxy-2-methylpropan-2-yl)-3-(3-nitrophenyl)prop-2-enamide(E)-N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)prop-2-enamide2-Propenamide, N-(2-hydroxy-1,1-dimethylethyl)-3-(3-nitrophenyl)-, (E)- (9CI)
(2E)-N-(2-hydroxy-tert-butyl)-3-(3-nitrophenyl)prop-2-enamide(E)-N-(1-hydroxy-2-methylpropan-2-yl)-3-(3-nitrophenyl)acrylamide(E)-N-(2-hydroxy-1,1-dimethyl-ethyl)-3-(3-nitrophenyl)prop-2-enamide
데이터베이스 식별자
- CAS
100098-62-2
물성
구조 계산 물성보충 중
- XLogP
- 1.4
- 극성 표면적
- 95.2 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 360
물리화학적 성질
- 끓는 점
- 507.9 · 507.9±50.0 °C(Predicted)
- 밀도
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.51 · 13.51±0.46(Predicted)
관련 반응
0건
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