Boc-Dap-OH

HCID 2755946

기본 정보

CAS
73259-81-1
표준 SMILES
CC(C)(C)OC(=O)N[C@@H](CN)C(=O)O
InChIKey
KRJLRVZLNABMAT-YFKPBYRVSA-N
분자식
C8H16N2O4
평균 분자량
204.22 g/mol
단동위원소 질량
204.11100699

이름 및 식별자

우선 이름
Boc-Dap-OH
IUPAC
(2S)-3-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
영어명
Boc-Dap-OH
분자식
C8H16N2O4
분자량
204.22

이름 및 동의어

73259-81-1Boc-Dap-OHDTXSID90373154RefChem:330030DTXCID90324186Boc-L-2,3-diaminopropionic acid3-Amino-Boc-L-alanineBOC-L-DAP-OH(S)-3-Amino-2-((tert-butoxycarbonyl)amino)propanoic acidMFCD00236843(2S)-3-amino-2-{[(tert-butoxy)carbonyl]amino}propanoic acid(2S)-3-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
이름 더 보기
BOC-L-DAP(S)-3-AMINO-2-(TERT-BUTOXYCARBONYLAMINO)PROPANOIC ACIDBOC-DPR-OHBoc-Dapa-OHBOC-L-DAPA-OH(N-Boc-β-amino)-AL3-Amino-Boc-L-alaninBoc-Dap-OH USP/EP/BP
3-Amino-N-Boc-L-alanineAlanine, 3-amino-N-[(1,1-dimethylethoxy)carbonyl]-3-Amino-N-[(tert-butoxy)carbonyl]alanine(2S)-3-amino-2-(tert-butoxycarbonylamino)propanoic acid3-Amino-N-(tert-butoxycarbonyl)-L-alanine(2S)-3-azaniumyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateN-Boc-L-2,3-diaminopropanoic acidHY-W008325

데이터베이스 식별자

CAS
73259-81-1
PubChem CID
2755946
DTXSID
DTXSID90373154
Nikkaji
J741.063H

물성

구조 계산 물성

XLogP
-2.7
극성 표면적
102 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
14

물리화학적 성질

녹는점
210 °C · 210 °C (dec.)
끓는 점
364.4 · 364.4±37.0 °C(Predicted)
밀도
1.189 · 1.189±0.06 g/cm3(Predicted)
저장 조건
2 · Keep in dark place,Inert atmosphere,2-8°C
용해도
DMSO(소량으로 용해, 난방, 초음파 처리), 물(약간의 가열, 초음파 처리)
물리적 상태
고체

화학적 성질

White powder

안전 및 규제

안전 데이터

wgk
3
HS 번호
29241990
safety_code
24/25
위험 등급
IRRITANT
F 고인화성물질
10
스토리지 클래스
11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도Reactant for:Protein assembly directed by synthetic molecular recognition motifsSolid phase synthesis of gramicidin S cyclic analogs with antibiotic and hemolytic activitiesSynthesis of HCV protease inhibitor modified analogsSolid phase synthesis of peptidic V1a receptor agonistsDirected peptide assembly at lipid-water interface

제조 방법 · 1건

The raw material was dissolved inabsolute ethanol (5 mL), and the reaction flask was immersed in a water bath at 25 C. To the alcoholicsolution, 10% palladium-carbon (22.9 mg) and 1,4-cyclohexadiene (10 equivalents with respect to4; 0.47 mL, 5.0 mmol) were added, and the mixture was allowed to react under magnetic stirringovernight. After filtration over a short pad of Celite 545, the solvent was evaporated under reducedpressure conditions, and the solid residue was partitioned in a 1:1 (v/v) H2O/EtOAc mixture (10 mL).The aqueous phase was separated, back extracted with EtOAc (3 10 mL), concentrated under reducedpressure conditions, and lyophilized.Finally, the target product Boc-Dap-OH is obtained.

공급사100 곳

北京华美互利生物化工010-56205725 · [email protected]
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]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

추가 설명

정의Boc-Dap-OH is an amino acid molecule that is a zwitterion. Therefore, the addition of a base is required to prepare a nucleophilic amino acid. It is commonly acts as a nucleophile to attack the acyl carbon.

관련 반응

18건

화합물 노트

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