(2S,4S)-1-tert-부틸2-메틸4-아미노피롤리딘-1,2-디카르복실레이트염산염
N-Boc-cis-4-amino-L-proline methyl ester hydrochloride
기본 정보
- CAS
171110-72-8- 표준 SMILES
COC(=O)[C@@H]1C[C@H](N)CN1C(=O)OC(C)(C)C.Cl- InChIKey
KFYCQKLSGMAVQH-WSZWBAFRSA-N- 분자식
- C11H21ClN2O4
- 평균 분자량
- 280.75 g/mol
- 단동위원소 질량
- 280.1189848
이름 및 식별자
- 우선 이름
- N-Boc-cis-4-amino-L-proline methyl ester hydrochloride
- IUPAC
- 1-O-tert-butyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride
- 현지명
- (2S,4S)-1-tert-부틸2-메틸4-아미노피롤리딘-1,2-디카르복실레이트염산염
- 영어명
- (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride
- 분자식
- C11H20N2O4.ClH
- 분자량
- 280.75
이름 및 동의어
N-BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDERefChem:829328802-010-8171110-72-8Methyl (2S,4S)-1-Boc-4-aminopyrrolidine-2-carboxylate hydrochloride(2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochlorideMFCD037879271-tert-butyl 2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate hydrochlorideBoc-cis-4-amino-L-proline methyl esterhydrochloride salt1-tert-butyl 2-methyl cis-4-aminopyrrolidine-1,2-dicarboxylate hydrochloride(2S,4S)-4-AMINO-1,2-PYRROLIDINEDICARBOXYLIC ACID 1-(1,1-DIMETHYLETHYL) 2-METHYL ESTER HYDROCHLORIDE1-O-tert-butyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride
이름 더 보기
(2S,4S)-1-tert-부틸2-메틸4-아미노피롤리딘-1,2-디카르복실레이트염산염Methyl (2S,4S)2-Fluoro-14-(methylthio)pyridine(S,S)-1-Boc-4-aminoproline methyl ester hydrochloride-1-Boc-4-aminopyrrolidine-2-carboxylate hydrochloridecis-4-Amino-N-Boc-L-prolinemethylesterhydrochloride,97%BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE SALT(2S,4S)-N-Boc-4-amino-L-proline methyl ester hydrochloridecis-4-AMino-N-Boc-L-proline Methyl ester hydrochloride, 97%N-BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE SALT
N-Boc-(2S,4S)-4-Amino-L-proline methyl ester HClKFYCQKLSGMAVQH-WSZWBAFRSA-N(2S-cis)-4-Amino-1,2-pyrrolidinedicarboxylic Acid 1-(1,1-Dimethylethyl) 2-Methyl Ester HydrochlorideSCHEMBL1412084DTXSID00592157AKOS015969096AKOS016015694CS-W014011
데이터베이스 식별자
- CAS
171110-72-8- PubChem CID
- 17998957
- DTXSID
DTXSID00592157- EC Number
- 802-010-8
물성
구조 계산 물성
- 극성 표면적
- 81.9 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 311
물리화학적 성질
- 녹는점
- 185 ℃ · ca 185℃
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 용해도
- 3 · 에 용해됨CDCl3, CD3OD
- 물리적 상태
- 고체
- 색상
- 회백색
- InChI
- InChI=1/C11H20N2O4.ClH/c1-11(2,3)17-10(15)13-6-7(12)5-8(13)9(14)16-4;/h7-8H,5-6,12H2,1-4H3;1H/t7-,8-;/s3
- InChIKey
- KFYCQKLSGMAVQH-BPYDWZBQNA-N
- SMILES
- C(N1C[C@@H](N)C[C@H]1C(=O)OC)(=O)OC(C)(C)C.Cl |&1:3,6,r|
화학적 성질
Off-White Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
안전 데이터
- HS 번호
- 2933998090
- 위험 등급
- IRRITANT
화학 및 산업
응용 분야
용도Proline derivative.
관련 반응
2건
화합물 노트
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