기본 정보
- 표준 SMILES
COC(=O)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C- InChIKey
AMBCTFGOVMCGIL-FGWVZKOKSA-N- 분자식
- C14H23NO4
- 평균 분자량
- 269.34 g/mol
이름 및 식별자
- 우선 이름
- Exo-8-boc-8-azabicyclo[3.2.1]octane-3-carboxylic acid methyl ester
- IUPAC
- 8-O-tert-butyl 3-O-methyl (1S,5R)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate
이름 및 동의어
1548292-34-71548548-51-1EXO-8-BOC-8-AZABICYCLO[3.2.1]OCTANE-3-CARBOXYLIC ACID METHYL ESTERExo-8-tert-butyl 3-methyl 8-azabicyclo[3.2.1]octane-3,8-dicarboxylateMFCD22415199Methyl endo-8-Boc-8-azabicyclo[3.2.1]octane-3-carboxylateMFCD31629674O8-tert-butyl O3-methyl endo-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate8-(tert-Butyl) 3-methyl (3-endo)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate8-O-tert-butyl 3-O-methyl (1R,5S)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylateendo-8-Azabicyclo[3.2.1]octane-3,8-dicarboxylic acid, 8-(1,1-dimethylethyl) 3-methyl esterMethyl exo-8-Boc-8-azabicyclo[3.2.1]octane-3-carboxylate
이름 더 보기
endo-8-(tert-butyl) 3-methyl 8-azabicyclo[3.2.1]octane-3,8-dicarboxylateO8-tert-butyl O3-methyl exo-8-azabicyclo[3.2.1]octane-3,8-dicarboxylateendo-8-?azabicyclo[3.2.1]?octane-?3,?8-?dicarboxylic acid, 8-?(1,?1-?dimethylethyl) 3-?methyl esterAMBCTFGOVMCGIL-FGWVZKOKSA-NSCHEMBL2671167SCHEMBL15437588SCHEMBL244245198-tert-butyl 3-methyl endo-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate
데이터베이스 식별자
- PubChem CID
- 67491395
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 55.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 360
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4건
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