Ethyl 2-amino-2-methylpropanoate hydrochloride

HCID 22343822

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 17288-15-2
표준 SMILES: CCOC(=O)C(C)(C)N.Cl
InChIKey: YREPHXXOTHNLEV-UHFFFAOYSA-N
분자식: C6H14ClNO2
평균 분자량: 167.63 g/mol
단동위원소 질량: 167.07130637

이름 및 식별자

우선 이름: Ethyl 2-amino-2-methylpropanoate hydrochloride
IUPAC: ethyl 2-amino-2-methylpropanoate;hydrochloride
영어명: 2-Amino-2-methyl-propionic acid ethyl ester hydrochloride
분자식: C6H14ClNO2
분자량: 167.63

이름 및 동의어

Ethyl 2-amino-2-methylpropanoate hydrochlorideRefChem:594099605-648-317288-15-2H-Aib-OEt.HCl2-Aminoisobutyric acid ethyl ester hydrochlorideMFCD06809830Ethyl 2-Amino-2-methyl-1-propionate Hydrochloride1-ethoxycarbonyl-1-methylethylamine hydrochlorideEthyl 2-amino-2-methylpropanoate HClH-Aib-oet hclethyl 2-methylalaninate hydrochloride

이름 더 보기

H-Aib-OEtAib-Oet.HCLL-Aib-OEt·HClIFLAB-BB F2108-0015propanoate hydrochLH-a-Me-Ala-OEt · HClH-α-Me-Ala-OEt · HClH-ALPHA-ME-ALA-OET HCL

ethyl 2-amino-2-methylpropanoate;hydrochlorideH-Aib-Oet hydrochlorideethyl aminoisobutyrate hydrochlorideETHYL ALPHA-AMINOISOBUTYRATE HYDROCHLORIDERE87Y8Q3K3SCHEMBL12789192-amino-2-methyl-propionic acid ethyl ester hydrochlorideDTXSID60625031

데이터베이스 식별자

CAS: 17288-15-2
PubChem CID: 22343822
DTXSID: DTXSID60625031
UNII: RE87Y8Q3K3
EC Number: 605-648-3

물성

구조 계산 물성

극성 표면적: 52.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 10
형식 전하: 0
복잡도: 110

물리화학적 성질

녹는점: 156 · 156-157 °C
저장 조건: 2 · Inert atmosphere,2-8°C
InChI: InChI=1S/C6H13NO2.ClH/c1-4-9-5(8)6(2,3)7;/h4,7H2,1-3H3;1H
InChIKey: YREPHXXOTHNLEV-UHFFFAOYSA-N
SMILES: C(OCC)(=O)C(C)(C)N.Cl

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.