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기본 정보
- CAS
55533-24-9- 표준 SMILES
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(N)cc1)C(=O)O- InChIKey
NDMVQEZKACRLDP-NSHDSACASA-N- 분자식
- C14H20N2O4
- 평균 분자량
- 280.32 g/mol
- 단동위원소 질량
- 280.14230712
이름 및 식별자
- 우선 이름
- (2S)-3-(4-aminophenyl)-2-{[(tert-butoxy)carbonyl]amino}propanoic acid
- IUPAC
- (2S)-3-(4-aminophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
- 영어명
- Boc-4-Amino-L-phenylalanine
- 분자식
- C14H20N2O4
- 분자량
- 280.32
이름 및 동의어
(2S)-3-(4-aminophenyl)-2-{[(tert-butoxy)carbonyl]amino}propanoic acid(2S)-3-(4-aminophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acidRefChem:398536811-732-255533-24-9Boc-Phe(4-NH2)-OHBOC-4-AMINO-L-PHENYLALANINEBoc-L-4-aminophenylalanine(S)-3-(4-Aminophenyl)-2-((tert-butoxycarbonyl)amino)propanoic acid4-Amino-N-Boc-L-phenylalanineBoc-p-amino-Phe-OHMFCD00038139
이름 더 보기
BOC-L-PHE(4-NH2)-OHBOC-PHE(P-NH2)-OHBOC-PHE(4'-NH2)-OHRARECHEM BK PT 0173
4-Amino-N-(tert-butoxycarbonyl)-L-phenylalanine(2S)-3-(4-aminophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidBoc-L-4-aminophe4-Amino-N-[(1,1-dimethylethoxy)carbonyl]-L-phenylalanineBoc-4-Amino-Phe-OH(2S)-3-(4-aminophenyl)-2-(tert-butoxycarbonylamino)propanoic acidboc-4-aminophenylalanineBoc-p-amino-L-Phe-OH
데이터베이스 식별자
- CAS
55533-24-9- PubChem CID
- 2761482
- DTXSID
물성
구조 계산 물성보충 중
- XLogP
- 1.1
- 극성 표면적
- 102 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 344
물리화학적 성질
- 녹는점
- 124 · 124-126℃
- 끓는 점
- 484.9 · 484.9±40.0 °C(Predicted)
- 밀도
- 1.213 · 1.213±0.06 g/cm3(Predicted)
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 용해도
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 3.74 · 3.74±0.10(Predicted)
- 색상
- White to off-white
- 주요 응용
- 펩타이드 합성
- InChI
- 1S/C14H20N2O4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-4-6-10(15)7-5-9/h4-7,11H,8,15H2,1-3H3,(H,16,19)(H,17,18)/t11-/m0/s1
- InChIKey
- NDMVQEZKACRLDP-NSHDSACASA-N
- SMILES
- CC(C)(C)OC(=O)N[C@@H](Cc1ccc(N)cc1)C(O)=O
화학적 성질
White to off white powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
Warning
H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.；There is 1 notification provided by 1 of 3 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)；Eye Irrit. 2A (33.3%)；STOT SE 3 (33.3%)
안전 데이터
- wgk
- 3
- HS 번호
- 29242990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-28
- 위험 등급
- IRRITANT
- 스토리지 클래스
- 13 - Non Combustible Solids
화학 및 산업
공급사100 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
Hangzhou Go Top Peptide Biotech0571-88211921 · [email protected]
上海嘉莱多生物技术有限责任公司021-61732478 19946252459 · [email protected]
VladaChem GmbH+49-7246-3082843 +86-18411632868 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
北京绿百草科技发展有限公司010-61136123 · [email protected]
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