기본 정보
- 표준 SMILES
COC(=O)C1CC(OS(C)(=O)=O)CN1C(=O)OC(C)(C)C- InChIKey
QXGDJXLJHBZELB-UHFFFAOYSA-N- 분자식
- C12H21NO7S
- 평균 분자량
- 323.36 g/mol
- 단동위원소 질량
- 323.10387318
이름 및 식별자
- 우선 이름
- 1-Tert-butyl 2-methyl 4-(methanesulfonyloxy)pyrrolidine-1,2-dicarboxylate
- IUPAC
- 1-O-tert-butyl 2-O-methyl 4-methylsulfonyloxypyrrolidine-1,2-dicarboxylate
이름 및 동의어
1-tert-butyl 2-methyl 4-(methanesulfonyloxy)pyrrolidine-1,2-dicarboxylatecis-n-boc-4-[(methylsulfonyl)oxy]-l-proline methyl esterSCHEMBL1154972QXGDJXLJHBZELB-UHFFFAOYSA-N1,2-Pyrrolidinedicarboxylic acid, 4-[(methylsulfonyl)oxy]-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S,4S)-SB12968DB-110659EN300-365953O1-tert-butyl O2-methyl 4-methylsulfonyloxypyrrolidine-1,2-dicarboxylate(2S,4R)-1-tert-Butyl 2-methyl 4-((methylsulfonyl)-oxy)pyrrolidine-1,2-dicarboxylate4-(Methanesulfonyloxy)pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester4-Methanesulfonyloxy-pyrrolidine-1,2-dicarboxylic Acid 1-t-butyl Ester 2-methyl Ester
이름 더 보기
4-methanesulfonyloxy-pyrrolidine-1,2-dicarboxylic acid-1-tert-butylester-2-methylester1-(tert-butyl) 2-methyl (2S,4R)-4-[(methylsulfonyl)oxy]tetrahydro-1H-pyrrole-1,2-dicarboxylate
데이터베이스 식별자
- PubChem CID
- 14772680
물성
구조 계산 물성
- XLogP
- 0.7
- 극성 표면적
- 108 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 503
관련 반응
20건
화합물 노트
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