Fmoc-leucine

HCID 1549133CAS 35661-60-0

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기본 정보

표준 SMILES: CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey: CBPJQFCAFFNICX-IBGZPJMESA-N
분자식: C21H23NO4
평균 분자량: 353.4 g/mol
단동위원소 질량: 353.16270822

개요

a leumedin; RN given for (L)-isomer

이름 및 식별자

우선 이름: Fmoc-leucine
IUPAC: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid

이름 및 동의어

35661-60-0fmoc-leucineN-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-leucinen-(fluorenyl-9-methoxycarbonyl)leucineN-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-leucineRefChem:828294252-662-7Fmoc-L-leucineFmoc-Leu-OHFmoc-L-Leu-OHN-Fmoc-L-leucineN-(9-fluorenylmethoxycarbonyl)-L-leucine

이름 더 보기

MFCD00037133(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid(((9H-fluoren-9-yl)methoxy)carbonyl)-L-leucineDTXSID0040751(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-methylpentanoic acidMLS002695993KF18F70UF3NPC-15199

데이터베이스 식별자

CAS: 35661-60-0
PubChem CID: 1549133
DTXSID: DTXSID0040751
ChEMBL: CHEMBL149394
UNII: KF18F70UF3
EC Number: 252-662-7
Nikkaji: J256.549H

물성

구조 계산 물성

XLogP: 4.4
극성 표면적: 75.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 7
무거운 원자 수: 26
형식 전하: 0
복잡도: 484

실험 및 물리화학적 성질

Chemical ClassesBiological Agents -> Amino Acids and Derivatives

Physical DescriptionSolid; [EMD Millipore MSDS]

Collision Cross Section · 2건

263.8 Å² [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID0040751]

186.02 Å² [M+K]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 40% (4 of 10) of reports.

Warning

H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 10 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.