(2R)-5-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-oxopentanoic acid

HCID 7018822
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기본 정보

CAS
104091-08-9
표준 SMILES
CC(C)(C)OC(=O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey
OTKXCALUHMPIGM-HXUWFJFHSA-N
분자식
C24H27NO6
평균 분자량
425.5 g/mol
단동위원소 질량
425.18383758

이름 및 식별자

우선 이름
(2R)-5-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-oxopentanoic acid
IUPAC
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
영어명
Fmoc-D-glutamic acid gamma-tert-butyl ester
분자식
C24H27NO6
분자량
425.47

이름 및 동의어

(2R)-5-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-oxopentanoic acid(2R)-5-(tert-butoxy)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-5-oxopentanoic acidRefChem:397395860-518-5Fmoc-D-Glu(OtBu)-OH104091-08-9Fmoc-D-glutamic acid 5-tert-butyl esterMFCD00077055(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-5-(tert-butoxy)-5-oxopentanoic acidN-Fmoc-D-glutamic Acid 5-tert-Butyl EsterM03413
이름 더 보기
FMOC-D-GLU(TBU)-OHFmoc-D-Glu(OtBu)-OH >=98.0% (HPLC)Fmoc-D-gFmoc-D-gLutamic acid g6-FmocQUINOLINEamma-tert-butyLFMoc-D-Glu(OBut)
D-Glutamic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-,5-(1,1-dimethylethyl) esterN-(9-Fluorenylmethoxycarbonyl)-D-glutamic acid 5-tert-butyl esterFmoc-D-glu(t-bu)-OHFmoc CD-Glu(Otbu)-OhFmoc-D-Glu(OtBu)-OH HSUK49HHL24SCHEMBL120511Fmoc-D-Glu(OtBu)-OH.H2O

데이터베이스 식별자

CAS
104091-08-9
PubChem CID
7018822
DTXSID
DTXSID60427037
UNII
SUK49HHL24
EC Number
860-518-5

물성

구조 계산 물성

XLogP
3.9
극성 표면적
102 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
10
무거운 원자 수
31

물리화학적 성질

녹는점
83 · 83-89 °C
끓는 점
633.5 · 633.5±55.0 °C(Predicted)
밀도
1.232 · 1.232±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
용해도
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
산도 계수 (pKa)
3.7 · 3.70±0.10(Predicted)

화학적 성질

white to light yellow crystal powde

안전 및 규제

GHS 분류

GHS Classification · 4건

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)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk
3
HS 번호
2924 29 70
safety_code
24/25
스토리지 클래스
11 - Combustible Solids

화학 및 산업

응용 분야

용도It is an important raw material and intermediate used in organic synthesis, agrochemicals and dyestuff.

상·하류 제품 정보

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hangzhou Go Top Peptide Biotech0571-88211921 · [email protected]

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