(1S,2S,4R)-N-BOC-1-아미노-2-히드록시시클로펜탄-4-카르복실산메틸에스테르
(1S,2S,4R)-N-Boc-1-amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester
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기본 정보
- CAS
262280-14-8- 표준 SMILES
COC(=O)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C1- InChIKey
SSATZBUCOTXXGA-VGMNWLOBSA-N- 분자식
- C12H21NO5
- 평균 분자량
- 259.3 g/mol
- 단동위원소 질량
- 259.14197277
이름 및 식별자
- 우선 이름
- (1S,2S,4R)-N-Boc-1-amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester
- IUPAC
- methyl (1R,3S,4S)-3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylate
- 현지명
- (1S,2S,4R)-N-BOC-1-아미노-2-히드록시시클로펜탄-4-카르복실산메틸에스테르
- 영어명
- (1S,2S,4R)-N-Boc-1-amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester
- 분자식
- C12H21NO5
- 분자량
- 259.3
이름 및 동의어
262280-14-8(1S,2S,4R)-N-Boc-1-amino-2-hydroxycyclopentane-4-carboxylic acid methyl estermethyl (1R,3S,4S)-3-{[(tert-butoxy)carbonyl]amino}-4-hydroxycyclopentane-1-carboxylateMFCD02259721(1R,3S,4S)-Methyl 3-((tert-butoxycarbonyl)amino)-4-hydroxycyclopentanecarboxylatemethyl (1R,3S,4S)-3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylate(1R,3S,4S)-3-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-hydroxycyclopentanecarboxylic Acid Methyl EsterCyclopentanecarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-, methyl ester, (1R,3S,4S)-METHYL (1R,3S,4S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-4-HYDROXYCYCLOPENTANE-1-CARBOXYLATEmethyl (1R,3S,4S)-3-((tert-butoxycarbonyl)amino)-4-hydroxycyclopentane-1-carboxylateSSATZBUCOTXXGA-VGMNWLOBSA-NSCHEMBL3546943
이름 더 보기
(1S,2S,4R)-N-BOC-1-아미노-2-히드록시시클로펜탄-4-카르복실산메틸에스테르METHYL (1R,3S,4S)-N-BOC-3-AMINO-4-HYDROXYCYCLOPENTANECARBOXYLATE(1S,2S,4R)-N-Boc-1-amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester, 95%,(1S,2S,4R)-N-BOC-1-Amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester, 98% ee(1S,2S,4R)-N-BOC-1-Amino-2-hydroxycyclopentane-4-carboxylic acid methyl ester,95%,98% eeCyclopentanecarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-, methyl ester, (1R,3S,4S)- (9CI)
DTXSID20427437BS-42766CS-0049306P17295F519340Methyl (1R,3S,4S)-3-(Boc-amino)-4-hydroxycyclopentane-1-carboxylate(1R,3S,4S)-Methyl3-((tert-butoxycarbonyl)amino)-4-hydroxycyclopentanecarboxylatemethyl (1R,3S,4S)-3-(tert-butoxycarbonylamino)-4-hydroxy-cyclopentanecarboxylate
데이터베이스 식별자
- CAS
262280-14-8- PubChem CID
- 7022354
- DTXSID
DTXSID20427437- Nikkaji
- J1.562.825A
물성
구조 계산 물성보충 중
- XLogP
- 0.7
- 극성 표면적
- 84.9 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 323
물리화학적 성질
- 끓는 점
- 402.56 °C · 402.56°C (rough estimate)
- 밀도
- 1.1623 · 1.1623 (rough estimate)
- 굴절률
- 1.4596 · 1.4596 (estimate)
화학적 성질
white to off-white crystalline powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- HS 번호
- 29221985
- safety_code
- 24/25
화학 및 산업
응용 분야
용도(1R,3S,4S)-3-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-hydroxycyclopentanecarboxylic Acid Methyl Ester is used in the synthesis of potent inactivators of γ-aminobutyric acid aminotransferase.
관련 반응
1건
화합물 노트
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