1-Ethylpiperidin-3-one hydrochloride

HCID 433439CAS 41361-28-8

基本情報

標準SMILES: CCN1CCCC(=O)C1
InChIKey: UDMMJJYIAHHNQA-UHFFFAOYSA-N
分子式: C7H13NO
平均分子量: 127.18 g/mol
単同位体質量: 127.09971404

名称と識別子

優先名称: 1-Ethylpiperidin-3-one hydrochloride
IUPAC: 1-ethylpiperidin-3-one

名称と別名

1-Ethylpiperidin-3-one HClEINECS 255-333-6NSC 3297003-Piperidinone, 1-ethyl-, hydrochlorideRefChem:432647255-333-61-Ethylpiperidin-3-one hydrochloride1-ethylpiperidin-3-one43152-93-81-Ethyl-3-piperidone1-Ethyl-3-piperidinone1-Ethyl-piperidin-3-one

名称をさらに表示

3-Piperidinone, 1-ethyl-N-ethyl-3-piperidoneN-ethylpiperid-3-one1-Ethyl-3-piperidinone #SCHEMBL64615SCHEMBL3431239SCHEMBL3431240AKOS006230063

データベース識別子

CAS: 41361-28-8
PubChem CID: 433439
EC Number: 255-333-6
Nikkaji: J108.768A

物性

構造計算による物性

XLogP: 0.5
極性表面積: 20.3 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 9
形式電荷: 0
複雑度: 111

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.