2-Amino-3-(4-iodophenyl)propionic acid

HCID 5152312

기본 정보

CAS: 14173-41-2
표준 SMILES: NC(Cc1ccc(I)cc1)C(=O)O
InChIKey: PZNQZSRPDOEBMS-UHFFFAOYSA-N
분자식: C9H10INO2
평균 분자량: 291.09 g/mol
단동위원소 질량: 290.97562656

개요

4-iodophenylalanine is a phenylalanine derivative that is phenylalanine carrying an iodo group at position 4 on the benzene ring. It is a phenylalanine derivative, an organoiodine compound and a non-proteinogenic alpha-amino acid.

이름 및 식별자

우선 이름: 2-Amino-3-(4-iodophenyl)propionic acid
IUPAC: 2-amino-3-(4-iodophenyl)propanoic acid
영어명: 4-Iodo-DL-phenylalanine
분자식: C9H10INO2
분자량: 291.09

이름 및 동의어

2-Amino-3-(4-iodophenyl)propionic acidRefChem:463753881-434-514173-41-22-amino-3-(4-iodophenyl)propanoic acid4-IODO-DL-PHENYLALANINEDL-4-iodophenylalanineH-DL-Phe(4-I)-OHMFCD00063066p-IODO-DL-PHENYLALANINEL-4-IodophenylalanineDL-P-IODOPHENYLALANINE

이름 더 보기

DL-Phe(4-I)-OHH-DL-PHE(P-I)-OHH-P-IODO-DL-PHE-OH4-Iodo-DL-phenylalanPhenylalanine, 4-iodo-

D-4-Iodophenylalanine;H-D-Phe(4-I)-OH(L)-4-iodophenylalanine4-iodo-D,L-phenylalanine4-Iodophenylalanine, DL-DL-Phenylalanine, 4-iodo-SCHEMBL446182G5DBU78P94-Iodophenylalanine, (+/-)-

데이터베이스 식별자

CAS: 14173-41-2
PubChem CID: 5152312
DTXSID: DTXSID20931185
ChEMBL: CHEMBL5308481
ChEBI: CHEBI:145892
UNII: 2G5DBU78P9
EC Number: 881-434-5
Nikkaji: J3.054.467F

물성

구조 계산 물성

XLogP: -0.9
극성 표면적: 63.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 178

물리화학적 성질

녹는점: 276 °C · 276°C
끓는 점: 366.8 · 366.8±32.0 °C(Predicted)
밀도: 1.824 · 1.824±0.06 g/cm3(Predicted)
저장 조건: Store at RT.
산도 계수 (pKa): 2.19 · 2.19±0.10(Predicted)
물리적 상태: Solid
색상: White to yellow

화학적 성질

White to off-white powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H302 (50%): 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 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 CategoriesAcute Tox. 4 (50%)

안전 데이터

HS 번호: 2922498590
hazard_code: Xi

화학 및 산업

공급사59 곳

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

江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]

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

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]

화합물 노트

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