기본 정보
- CAS
1932444-00-2- 표준 SMILES
CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CO- InChIKey
KXNPTSIIVCAMOC-SFYZADRCSA-N- 분자식
- C10H19NO3
- 평균 분자량
- 201.26 g/mol
- 단동위원소 질량
- 201.13649347
이름 및 식별자
- 우선 이름
- tert-butyl cis-N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]carbamate
- IUPAC
- tert-butyl N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]carbamate
- 영어명
- Carbamic acid, N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]-, 1,1-dimethylethyl ester
- 분자식
- C10H19NO3
- 분자량
- 201.26
이름 및 동의어
1932444-00-2167255-49-4tert-butyl cis-N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]carbamateTERT-BUTYL (((1S,2R)-2-(HYDROXYMETHYL)CYCLOPROPYL)METHYL)CARBAMATEN-Boc-[(1R,2S)-2-(aminomethyl)cyclopropyl]methanolCarbamic acid,[[2-(hydroxymethyl)cyclopropyl]methyl]-, 1,1-dimethylethyl ester, cis- (9CI)[(1R,2S)-2-[(Boc-amino)methyl]cyclopropyl]methanolSCHEMBL8749704KXNPTSIIVCAMOC-SFYZADRCSA-N153861-59-7MFCD34646098Tert-butyl N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]carbamate
이름 더 보기
N-Boc((1S,2R)-2-(aminomethyl)cyclopropyl)methanol(1R,2S)-2-[(Boc-amino)methyl]cyclopropyl]methanoltert-butyl N-{[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl}carbamateCarbamic acid, N-[[(1S,2R)-2-(hydroxymethyl)cyclopropyl]methyl]-, 1,1-dimethylethyl ester
AT35260AT35265PS-20163SY368333cis-2-(N-BOC-aminomethyl)-cyclopropanemethanolcis-2-(N-BOC-aminomethyl )-cyclopropanemethanolN-Boc((1R,2S)-2-(aminomethyl)cyclopropyl)methanolRAC-TERT-BUTYL (((1R,2S)-2-(HYDROXYMETHYL)CYCLOPROPYL)METHYL)CARBAMATE
데이터베이스 식별자
- CAS
1932444-00-2- PubChem CID
- 11820138
물성
구조 계산 물성
- XLogP
- 0.9
- 극성 표면적
- 58.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 210
물리화학적 성질
- 끓는 점
- 317 · 317.0±15.0 °C(Predicted)
- 밀도
- 1.071 · 1.071±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.86 · 12.86±0.46(Predicted)
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