기본 정보
- CAS
122996-47-8- 표준 SMILES
CC(C)(C)O[C@@H]1C[C@@H](C(=O)O)N(C(=O)OCC2c3ccccc3-c3ccccc32)C1- InChIKey
WPBXBYOKQUEIDW-VFNWGFHPSA-N- 분자식
- C24H27NO5
- 평균 분자량
- 409.5 g/mol
- 단동위원소 질량
- 409.18892296
이름 및 식별자
- 우선 이름
- (2S,4R)-4-(tert-butoxy)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidine-2-carboxylic acid
- IUPAC
- (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-[(2-methylpropan-2-yl)oxy]pyrrolidine-2-carboxylic acid
- 영어명
- Fmoc-Hyp(tBu)-OH
- 분자식
- C24H27NO5
- 분자량
- 409.48
이름 및 동의어
(2S,4R)-4-(tert-butoxy)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidine-2-carboxylic acid(2S,4R)-4-(tert-butoxy)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)pyrrolidine-2-carboxylic acidRefChem:398939857-376-1Fmoc-Hyp(tBu)-OH122996-47-8fmoc-4-tert-butoxy-l-prolineFmoc-L-Hyp(tBu)-OHMFCD00151930(2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-[(2-methylpropan-2-yl)oxy]pyrrolidine-2-carboxylic acidSCHEMBL118220Fmoc-O-tert-butyl-L-trans-4-hydroxyproline
이름 더 보기
Fmoc-Hyp(OtBu)-OHFmoc-Hyp(tBu)FMOC-HYP(BUT)-OHtrans-N-Fmoc-4-tert-butoxy-L-proline(2S)-1-(((9H-FLUOREN-9-YL)METHOXY)CARBONYL)-4-(TERT-BUTOXY)PYRROLIDINE-2-CARBOXYLIC ACIDFmoc-Hyp(tBu)-OH 97%
(2S,4R)-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)-4-(tert-butoxy)pyrrolidine-2-carboxylic acidFmoc-O-tert-butyl-L-hydroxyprolineTrans-N-Fmoc-4-(tert-butoxy)-L-prolineFmoc-D-Hyp(tBu)-OHN-alpha-Fmoc-O-tert-butyl-L-trans-4-hydroxyprolineN-[(9H-Fluoren-9-ylmethoxy)carbonyl]-4-trans-(tert-butoxy)-L-prolineFmoc-(2S,4R)-(-)-4-t-butoxypyrrolidine-2-carboxylic acid1,2-Pyrrolidinedicarboxylic acid, 4-(1,1-dimethylethoxy)-, 1-(9H-fluoren-9-ylmethyl) ester, (2S,4R)-
데이터베이스 식별자
- CAS
122996-47-8、464193-92-8- PubChem CID
- 978347
- UNII
- 683B4EM2ZX
- EC Number
- 857-376-1
- Nikkaji
- J2.301.051H
물성
구조 계산 물성
- XLogP
- 3.9
- 극성 표면적
- 76.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 622
물리화학적 성질
- 녹는점
- 63 °C · ~63 °C
- 끓는 점
- 578.6 · 578.6±50.0 °C(Predicted)
- 밀도
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
- 용해도
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 3.71 · 3.71±0.40(Predicted)
- 색상
- 하얀색
- BRN
- 6161467 · 6161467
- 주요 응용
- 펩타이드 합성
- InChIKey
- WPBXBYOKQUEIDW-VFNWGFHPSA-N
- SMILES
- N1(C(OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)=O)C[C@H](OC(C)(C)C)C[C@H]1C(O)=O
화학적 성질
Light yellow Crystalline
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.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- HS 번호
- 2933 99 80
- safety_code
- 22-24/25
- 위험 등급
- IRRITANT
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Fmoc-Hyp(tBu)-OH, is an amino acid derivative, used in chemical synthesis and peptide chemistry.
공급사100 곳
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