((2S)-2-(Diphenylmethyl)-1-pyrrolidinyl)((2S,4R)-4-hydroxy-2-pyrrolidinyl)methanone
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기본 정보
- CAS
915205-77-5- 표준 SMILES
O=C([C@@H]1C[C@@H](O)CN1)N1CCC[C@H]1C(c1ccccc1)c1ccccc1- InChIKey
NYZAYIQCFFHZGK-AABGKKOBSA-N- 분자식
- C22H26N2O2
- 평균 분자량
- 350.5 g/mol
- 단동위원소 질량
- 350.19942808
이름 및 식별자
- 우선 이름
- ((2S)-2-(Diphenylmethyl)-1-pyrrolidinyl)((2S,4R)-4-hydroxy-2-pyrrolidinyl)methanone
- IUPAC
- [(2S)-2-benzhydrylpyrrolidin-1-yl]-[(2S,4R)-4-hydroxypyrrolidin-2-yl]methanone
- 영어명
- ((S)-2-Benzhydrylpyrrolidin-1-yl)((2S,4R)-4-hydroxypyrrolidin-2-yl)-methanone
- 분자식
- C22H26N2O2
- 분자량
- 350.45
이름 및 동의어
915205-77-5[(2S)-2-(Diphenylmethyl)-1-pyrrolidinyl][(2S,4R)-4-hydroxy-2-pyrrolidinyl]methanone((2S)-2-(Diphenylmethyl)-1-pyrrolidinyl)((2S,4R)-4-hydroxy-2-pyrrolidinyl)methanoneRefChem:203566[(2S)-2-(Diphenylmethyl)pyrrolidin-1-yl][(2S,4R)-4-hydroxypyrrolidin-2-yl]methanone((S)-2-Benzhydrylpyrrolidin-1-yl)((2S,4R)-4-hydroxypyrrolidin-2-yl)methanoneMethanone,[(2S)-2-(diphenylmethyl)-1-pyrrolidinyl][(2S,4R)-4-hydroxy-2-pyrrolidinyl]-OTHER CA INDEX NAMES:Pyrrolidine,2-(diphenylmethyl)-1-[[(2S,4R)-4-hydroxy-2-pyrrolidinyl]carbonyl]-, (2S)-((S)-2-Benzhydrylpyrrolidin-1-yl)((2S,4R)-4-hydroxypyrrolidin-2-yl)-methanoneSCHEMBL15481302DTXSID701129587[(2S)-2-benzhydrylpyrrolidin-1-yl]-[(2S,4R)-4-hydroxypyrrolidin-2-yl]methanoneCS-0104796
이름 더 보기
[(2S)-2-(Diphenylmethyl)pyrrolidin-1-yl][(2S,4R)-4- hydroxypyrrolidin-2-yl]methanoneMethanone, [(2S)-2-(diphenylmethyl)-1-pyrrolidinyl][(2S,4R)-4-hydroxy-2-pyrrolidinyl]-[(2S)-2-(Diphenylmethyl)pyrrolidin-1-yl][(2S,4R)-4- hydroxypyrrolidin-2-yl]methanone,99%e.e.
((S)-2-Benzhydrylpyrrolidin-1-yl)((2S,4R)-4-hydroxypyrrolidin-2-yl)-methanone, 99% (HPLC)
데이터베이스 식별자
- CAS
915205-77-5- PubChem CID
- 11973845
- DTXSID
DTXSID701129587- Nikkaji
- J2.369.716E
물성
구조 계산 물성보충 중
- XLogP
- 2.8
- 극성 표면적
- 52.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 453
물리화학적 성질
- 녹는점
- 58 · 58-59 °C(Solv: hexane (110-54-3); ethyl ether (60-29-7))
- 끓는 점
- 560.3 · 560.3±50.0 °C(Predicted)
- 밀도
- 1.204 · 1.204±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 14.56 · 14.56±0.40(Predicted)
관련 반응
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