기본 정보
- 표준 SMILES
COC(=O)CC1(COS(C)(=O)=O)CC1- InChIKey
SWSNDKHMSTTXPA-UHFFFAOYSA-N- 분자식
- C8H14O5S
- 평균 분자량
- 222.26 g/mol
- 단동위원소 질량
- 222.05619472
이름 및 식별자
- 우선 이름
- Methyl 2-(1-[(methanesulfonyloxy)-methyl]cyclopropyl)acetate
- IUPAC
- methyl 2-[1-(methylsulfonyloxymethyl)cyclopropyl]acetate
이름 및 동의어
170721-48-9Methyl 2-(1-[(methanesulfonyloxy)-methyl]cyclopropyl)acetatemethyl 2-[1-(methylsulfonyloxymethyl)cyclopropyl]acetateMethyl 2-(1-(((methylsulfonyl)oxy)methyl)cyclopropyl)acetatemethyl 2-(1-{[(methylsulfonyl)oxy]methyl}cyclopropyl)acetateSCHEMBL1484479SWSNDKHMSTTXPA-UHFFFAOYSA-NDB-297777methyl (1-{[(methylsulfonyl)oxy]methyl}cyclopropyl)acetatemethyl(1-{[(methylsulfonyl)oxy]methyl}cyclopropyl)acetateMethyl 2-(1-1 [(methylsulfonyl)oxy]methylcyclopropyl)acetate(1-methanesulfonyloxymethyl-cyclopropyl)-acetic acid methyl ester
데이터베이스 식별자
- PubChem CID
- 58203553
물성
구조 계산 물성
- XLogP
- 0.1
- 극성 표면적
- 78.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 309
관련 반응
9건
화합물 노트
불러오는 중…