N-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-alanine

HCID 6364642CAS 35661-39-3

기본 정보

표준 SMILES: C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey: QWXZOFZKSQXPDC-NSHDSACASA-N
분자식: C18H17NO4
평균 분자량: 311.3 g/mol
단동위원소 질량: 311.11575802

이름 및 식별자

우선 이름: N-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-alanine
IUPAC: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid

이름 및 동의어

35661-39-3N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-alanineDTXSID001245823N-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-alanineEINECS 252-660-6NSC 334296FMOCAlaOH NovabiochemRefChem:823140DTXCID501676675252-660-6Fmoc-Ala-OHFmoc-L-alanine

이름 더 보기

N-Fmoc-L-alanineFMOC-L-ALA-OHMFCD00037139L-Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acidN-(9-Fluorenylmethoxycarbonyl)-L-alanineSCHEMBL119044Fmoc-L-Alanine monohydrate

데이터베이스 식별자

CAS: 35661-39-3
PubChem CID: 6364642
DTXSID: DTXSID001245823
ChEMBL: CHEMBL4284055
UNII: 352A2N82BU
EC Number: 252-660-6
Nikkaji: J256.555B

물성

구조 계산 물성

XLogP: 3.1
극성 표면적: 75.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 23
형식 전하: 0
복잡도: 430

실험 및 물리화학적 성질

Chemical ClassesBiological Agents -> Amino Acids and Derivatives

Physical DescriptionWhite to light yellow solid; [EMD Millipore MSDS]

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 72.7% (8 of 11) of all reports.

Warning

H302 (18.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 11 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.