기본 정보
- CAS
214601-16-8- 표준 SMILES
COC(=O)c1ccc(O)c(C(CCN(C(C)C)C(C)C)c2ccccc2)c1- InChIKey
LAPCBEFVTNSDFY-UHFFFAOYSA-N- 분자식
- C23H31NO3
- 평균 분자량
- 369.5 g/mol
- 단동위원소 질량
- 369.23039385
이름 및 식별자
- 우선 이름
- N,N-Diisopropyl-3-[(5-methoxycarbonyl)-2-hydroxy)phenyl]-3-phenyl-propylamine
- IUPAC
- methyl 3-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-hydroxybenzoate
- 현지명
- N,N-디이소프로필-3-[(5-메톡시카르보닐)-2-히드록시)페닐]-3-페닐-프로필아민
- 영어명
- N,N-Diisopropyl-3-[(5-methoxycarbonyl)-2-hydroxy)phenyl]-3-phenyl-propylamine
- 분자식
- C23H31NO3
- 분자량
- 369.5
이름 및 동의어
214601-16-8N,N-Diisopropyl-3-[(5-methoxycarbonyl)-2-hydroxy)phenyl]-3-phenyl-propylaminemethyl 3-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-hydroxybenzoateMethyl 3-{3-[di(propan-2-yl)amino]-1-phenylpropyl}-4-hydroxybenzoate3-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxy-benzoic Acid Methyl Ester;LAPCBEFVTNSDFY-UHFFFAOYSA-NSCHEMBL1811659DTXSID501151459methyl 3-[3-(diisopropylamino)-1-phenyl-propyl]-4-hydroxy-benzoateAKOS030254368Methyl 3-(3-(diisopropylamino)-1-phenylpropyl)-4-hydroxybenzoatemethyl 3-(3-diisopropylamino-1-phenyl-propyl)-4-hydroxy-benzoate
이름 더 보기
N,N-디이소프로필-3-[(5-메톡시카르보닐)-2-히드록시)페닐]-3-페닐-프로필아민3-[3-[Bis(1-Methylethyl)aMino]-1-phenylpropyl]-4-hydroxy-benzoic Acid Methyl EsterBenzoic acid, 3-[3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxy-, methyl esterN,N-Diisopropyl-3-[(5-methoxycarbonyl)-2-hydroxy)phenyl]-3-phenyl-propylamine, CAS 214601-16-8
Methyl 3-[3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxybenzoate
물성
구조 계산 물성
- XLogP
- 5.1
- 극성 표면적
- 49.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 437
물리화학적 성질
- 녹는점
- 50 °C · 50°C
- 끓는 점
- 495.6 · 495.6±45.0 °C(Predicted)
- 밀도
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- 용해도
- 디클로로메탄, 에틸아세테이트, 메탄올에 용해됨
- 물리적 상태
- 포말 모양
- 산도 계수 (pKa)
- 8.22 · 8.22±0.48(Predicted)
- 색상
- 옅은 노랑
화학적 성질
Pale Yellow Foam
화학 및 산업
응용 분야
용도N,N-Diisopropyl-3-[(5-methoxycarbonyl)-2-hydroxy)phenyl]-3-phenyl-propylamine (cas# 214601-16-8) is a compound useful in organic synthesis.
공급사7 곳
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