N-alpha-(9-Fluorenylmethyloxycarbonyl)-N-alpha-methyl-L-aspartic acid beta-t-butyl ester

HCID 7019716CAS 152548-66-8

기본 정보

표준 SMILES: CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](CC(=O)OC(C)(C)C)C(=O)O
InChIKey: CYWWLVIEAOUXGW-FQEVSTJZSA-N
분자식: C24H27NO6
평균 분자량: 425.5 g/mol

이름 및 식별자

우선 이름: N-alpha-(9-Fluorenylmethyloxycarbonyl)-N-alpha-methyl-L-aspartic acid beta-t-butyl ester
IUPAC: (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
영어명: Fmoc-N-methyl-L-aspartic acid 4-tert-butyl ester
분자식: C24H27NO6
분자량: 425.48

이름 및 동의어

152548-66-8RefChem:828981N-alpha-(9-Fluorenylmethyloxycarbonyl)-N-alpha-methyl-L-aspartic acid beta-t-butyl ester802-787-3Fmoc-N-Me-Asp(OtBu)-OHFmoc-MeAsp(OtBu)-OHfmoc-n-methyl-l-aspartic acid 4-tert-butyl esterMFCD00237027(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid(2S)-4-tert-butoxy-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-4-oxo-butanoic acidFmoc-N-Me-L-Asp(OtBu)-OHFmoc-N-methyl-L-aspartic acid b-tert-butyl ester

이름 더 보기

FMOC-L-MEASP(TBU)-OHFmoc-L-NMe-Asp(OtBu)Fmoc-N-Me-Asp(OBu)-OHFMOC-N-ME-ASP(OBUT)-OHFmoc-N-Me-L-Asp（OtBu）-OHFmoc-N-Me-Asp(OtBu)-OH 97%

(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-4-(tert-butoxy)-4-oxobutanoic acidN-Fmoc-N-methyl-L-aspartic Acid 4-tert-Butyl Ester(S)-2-[(9H-fluoren-9-ylmethoxycarbonyl)-methyl-amino]-succinic acid 4-tert-butyl esterAM84484SCHEMBL1759730SCHEMBL29401359SCHEMBL30191555CYWWLVIEAOUXGW-FQEVSTJZSA-N

데이터베이스 식별자

CAS: 152548-66-8
PubChem CID: 7019716
EC Number: 802-787-3

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 93.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 9
무거운 원자 수: 31
형식 전하: 0
복잡도: 649

물리화학적 성질

녹는점: 135 · 135-140°C
끓는 점: 598.7 · 598.7±50.0 °C(Predicted)
밀도: 1.237 · 1.237±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: 1 % · Soluble in water or 1% acetic acid
물리적 상태: 가루
산도 계수 (pKa): 3.59 · 3.59±0.23(Predicted)
색상: White to off-white
주요 응용: 펩타이드 합성
InChI: InChI=1S/C24H27NO6/c1-24(2,3)31-21(26)13-20(22(27)28)25(4)23(29)30-14-19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19/h5-12,19-20H,13-14H2,1-4H3,(H,27,28)/t20-/m0/s1
InChIKey: CYWWLVIEAOUXGW-FQEVSTJZSA-N
SMILES: C(O)(=O)[C@H](CC(OC(C)(C)C)=O)N(C(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)C

화학적 성질

White to off-white solid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 2.5% (1 of 40) of reports.

Warning

H400 (97.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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 CategoriesAquatic Acute 1 (97.5%)

안전 데이터

wgk: 3
HS 번호: 2924 29 70
risk_code: 50/53
hazard_code: N
safety_code: 60-61
위험 등급: IRRITANT
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도Fmoc protected N-methyl amino acid suitable for solid phase peptide synthesis. N-methyl amino acids have been shown to improve proteolytic stability of peptides.

공급사50 곳

北京华美互利生物化工010-56205725 · [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051580855088 18762539991 · [email protected]

普洛药业股份有限公司/浙江横店普洛进出口有限公司+86-0571-87635730 +86-13588737631

江苏生康迈翔科技有限公司18217475093 · [email protected]

연결된 노트

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