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기본 정보
- CAS
148017-07-6- 표준 SMILES
CC(C)(C)OC(=O)N1C[C@H](OS(C)(=O)=O)C[C@H]1CO- InChIKey
GBUOWVDRNWNHOE-DTWKUNHWSA-N- 분자식
- C11H21NO6S
- 평균 분자량
- 295.35 g/mol
- 단동위원소 질량
- 295.10895856
이름 및 식별자
- 우선 이름
- (2S,4R)-Tert-butyl 2-(hydroxymethyl)-4-(methylsulfonyloxy)pyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (2S,4R)-2-(hydroxymethyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate
- 영어명
- (2S,4R)-tert-Butyl 2-(hydroxymethyl)-4-(methylsulfonyloxy)pyrrolidine-1-carboxylate
- 분자식
- C11H21NO6S
- 분자량
- 295.35
이름 및 동의어
148017-07-6tert-butyl (2S,4R)-2-(hydroxymethyl)-4-(methanesulfonyloxy)pyrrolidine-1-carboxylate(2S,4R)-TERT-BUTYL 2-(HYDROXYMETHYL)-4-(METHYLSULFONYLOXY)PYRROLIDINE-1-CARBOXYLATEMFCD03695502tert-butyl (2S,4R)-2-(hydroxymethyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate(2S,4R)-tert-Butyl 2-(hydroxymethyl)-4-((methylsulfonyl)oxy)pyrrolidine-1-carboxylateSCHEMBL7712017GBUOWVDRNWNHOE-DTWKUNHWSA-NAKOS030531339AS-54055CS-0048607P17447
이름 더 보기
(2S,4R)-N-tetr-butoxycarbonyl-4-methanesul fonyloxy-2-hydroxymethylpyrrolidine1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-4-[(methylsulfonyl)oxy]-, 1,1-dimethylethyl ester, (2S,4R)-
(2S,4R)-1-Boc-2-(hydroxymethyl)-4-(methanesulfonyloxy)pyrrolidine(2S, 4R)-1-t-butoxycarbonyl-4-methanesulfonyloxypyrrolidine-2-methanol(2S,4R)-1-t-butoxycarbonyl-4-methanesulfonyloxypyrrolidine-2-methanol(2S,4R)-N-tert-butoxycarbonyl-4-methanesulfonyloxy-2-hydorxymethylpyrrolidine(2S,4R)-N-tert-Butoxycarbonyl-4-methanesulfonyloxy-2-hydroxymethylpyrrolidine(2S,4R)-tert-Butyl2-(hydroxymethyl)-4-((methylsulfonyl)oxy)pyrrolidine-1-carboxylatet-Butyl (2S,4R)-2-(hydroxymethyl)-4-(methanesulfonyloxy)pyrrolidine-1-carboxylatetert-butyl (2S,4R)-2-(hydroxymethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate
데이터베이스 식별자
- CAS
148017-07-6- PubChem CID
- 10589967
- Nikkaji
- J1.659.658B
물성
구조 계산 물성보충 중
- XLogP
- 0.1
- 극성 표면적
- 102 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 421
물리화학적 성질
- 끓는 점
- 452.2 · 452.2±38.0 °C(Predicted)
- 밀도
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 14.77 · 14.77±0.10(Predicted)
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