4-아미노페닐알라닌

4-Aminophenylalanine

HCID 151001

기본 정보

CAS: 2410-24-4
표준 SMILES: Nc1ccc(C[C@H](N)C(=O)O)cc1
InChIKey: CMUHFUGDYMFHEI-QMMMGPOBSA-N
분자식: C9H12N2O2
평균 분자량: 180.2 g/mol
단동위원소 질량: 180.08987762

개요

4-amino-L-phenylalanine is the L-enantiomer of 4-aminophenylalanine. It is an enantiomer of a 4-amino-D-phenylalanine. It is a tautomer of a 4-amino-L-phenylalanine zwitterion.

이름 및 식별자

우선 이름: 4-Aminophenylalanine
IUPAC: (2S)-2-amino-3-(4-aminophenyl)propanoic acid
현지명: 4-아미노페닐알라닌
영어명: 4-aminophenylalanine
분자식: C9H12N2O2
분자량: 0

이름 및 동의어

4-Amino-L-Phenylalanine943-80-6p-amino-l-phenylalanine(2S)-2-amino-3-(4-aminophenyl)propanoic acidp-Aminophenylalanine4-Aminophenylalanine2410-24-4aminophenylalaninepara-AminophenylalanineL-Phenylalanine, 4-amino-L-(+)-p-Aminophenylalanine(S)-2-Amino-3-(4-aminophenyl)propionic acid

이름 더 보기

4-아미노페닐알라닌para-Amino-phe

1567B560CHCHEBI:29737DTXSID90178828CHEBI:143078(2S)-3-(4-aminophenyl)-2-azaniumylpropanoateRefChem:518272DTXCID50101319H-Phe(4-NH2)-OH

데이터베이스 식별자

CAS: 2410-24-4、943-80-6
PubChem CID: 151001
DTXSID: DTXSID90178828
ChEMBL: CHEMBL231389
ChEBI: CHEBI:29737
UNII: 1567B560CH
EC Number: 633-631-0
Nikkaji: J80.036H

물성

구조 계산 물성

XLogP: -2.2
극성 표면적: 89.3 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 176

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

H315 (97.5%): 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.