Ethyl 2-amino-2-ethylbutanoate hydrochloride

HCID 24201639CAS 1135219-29-2

基本情報

標準SMILES: CCOC(=O)C(N)(CC)CC.Cl
InChIKey: GQERJQAZXHCDQN-UHFFFAOYSA-N
分子式: C8H18ClNO2
平均分子量: 195.69 g/mol
単同位体質量: 195.1026065

名称と識別子

優先名称: Ethyl 2-amino-2-ethylbutanoate hydrochloride
IUPAC: ethyl 2-amino-2-ethylbutanoate;hydrochloride

名称と別名

ethyl 2-amino-2-ethylbutanoate hydrochloride1135219-29-2RefChem:594097833-375-1ethyl 2-amino-2-ethylbutanoate;hydrochlorideSCHEMBL14152453GQERJQAZXHCDQN-UHFFFAOYSA-NKVB21929NSC522555NSC-522555ethyl2-amino-2-ethylbutanoatehydrochlorideCS-0135430

名称をさらに表示

ethyl 2-amino-2-ethyl-butanoate;hydrochlorideEN300-2215692-amino-2-ethyl-butanoic acid ethyl ester hydrochlorideZ2213893375

データベース識別子

CAS: 1135219-29-2
PubChem CID: 24201639
EC Number: 833-375-1

物性

構造計算による物性

極性表面積: 52.3 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 5
重原子数: 12
形式電荷: 0
複雑度: 130

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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.