기본 정보
- 표준 SMILES
COC(=O)[C@@]1(C)C[C@@H](O)CN1C(=O)OC(C)(C)C- InChIKey
CTBPJCTYTFHHRY-PRHODGIISA-N- 분자식
- C12H21NO5
- 평균 분자량
- 259.3 g/mol
이름 및 식별자
- 우선 이름
- 1-(Tert-butyl) 2-methyl (2R,4R)-4-hydroxy-2-methylpyrrolidine-1,2-dicarboxylate
- IUPAC
- 1-O-tert-butyl 2-O-methyl (2R,4R)-4-hydroxy-2-methylpyrrolidine-1,2-dicarboxylate
이름 및 동의어
144527-32-21-(TERT-BUTYL) 2-METHYL (2R,4R)-4-HYDROXY-2-METHYLPYRROLIDINE-1,2-DICARBOXYLATE1-O-tert-butyl 2-O-methyl (2R,4R)-4-hydroxy-2-methylpyrrolidine-1,2-dicarboxylateSCHEMBL15212714WLZ4261CTBPJCTYTFHHRY-PRHODGIISA-NMFCD30803144F5374651-(t-Butyl) 2-methyl (2R,4R)-4-hydroxy-2-methylpyrrolidine-1,2-dicarboxylate1-(TERT-BUTYL)2-METHYL(2R,4R)-4-HYDROXY-2-METHYLPYRROLIDINE-1,2-DICARBOXYLATE(2R,4R)-4-hydroxy-2-methyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester
데이터베이스 식별자
- PubChem CID
- 10539202
- Nikkaji
- J787.081G
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 76.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 349
관련 반응
2건
화합물 노트
불러오는 중…