기본 정보
- 표준 SMILES
Cc1ccc(S(=O)(=O)OCC2CCCN2C(=O)OC(C)(C)C)cc1- InChIKey
VSVOPDINJSHSBZ-UHFFFAOYSA-N- 분자식
- C17H25NO5S
- 평균 분자량
- 355.5 g/mol
이름 및 식별자
- 우선 이름
- tert-Butyl 2-((tosyloxy)methyl)pyrrolidine-1-carboxylate
- IUPAC
- tert-butyl 2-[(4-methylphenyl)sulfonyloxymethyl]pyrrolidine-1-carboxylate
이름 및 동의어
136235-11-5tert-Butyl 2-((tosyloxy)methyl)pyrrolidine-1-carboxylate2-(Toluene-4-sulfonyloxymethyl)-pyrrolidine-1-carboxylic acid tert-butyl estertert-butyl 2-{[(4-methylbenzenesulfonyl)oxy]methyl}pyrrolidine-1-carboxylatetert-butyl 2-[(4-methylphenyl)sulfonyloxymethyl]pyrrolidine-1-carboxylateSCHEMBL143674VSVOPDINJSHSBZ-UHFFFAOYSA-Ntert-butyl 2-(p-tolylsulfonyloxymethyl)pyrrolidine-1-carboxylateAKOS000280727AKOS027390443HS-8090SB49123
이름 더 보기
SB50646DB-250792tert-Butyl2-((tosyloxy)methyl)pyrrolidine-1-carboxylate(R)-tert-Butyl 2-((tosyloxy)methyl)-pyrrolidine-1-carboxylateN-(tert-butoxycarbonyl)-2-pyrrolidinylmethyl p-toluenesulfonateN-(tert-butoxy carbonyl)-2-pyrrolidinylmethyl p-toluenesulfonate(S)-TERT-BUTYL 2-((TOSYLOXY)METHYL)-PYRROLIDINE-1-CARBOXYLATE
데이터베이스 식별자
- PubChem CID
- 13110388
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 81.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 526
관련 반응
33건
화합물 노트
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