N,N-Diethylglycine

HCID 74151CAS 1606-01-5

基本情報

標準SMILES: CCN(CC)CC(=O)O
InChIKey: SGXDXUYKISDCAZ-UHFFFAOYSA-N
分子式: C6H13NO2
平均分子量: 131.17 g/mol
単同位体質量: 131.09462866

名称と識別子

優先名称: N,N-Diethylglycine
IUPAC: 2-(diethylamino)acetic acid

名称と別名

1606-01-5N,N-Diethylglycine2-(diethylamino)acetic acidGlycine, N,N-diethyl-N,N-diethylaminoacetic acid(Diethylamino)acetic acidUNII-GWC379GNX7GWC379GNX7Glycine N,N-diethyl-EINECS 216-520-8DTXSID30166941RefChem:161193

名称をさらに表示

DTXCID0089432216-520-8diethylglycineDiethylamino-acetic acidMFCD00461044Diethylaminoacetic acidN,N-diethyl-glycine2-(diethylamino)aceticacid

データベース識別子

CAS: 1606-01-5
PubChem CID: 74151
DTXSID: DTXSID30166941
ChEBI: CHEBI:80633
UNII: GWC379GNX7
EC Number: 216-520-8
Nikkaji: J80.257C

物性

構造計算による物性

XLogP: -1.7
極性表面積: 40.5 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 4
重原子数: 9
形式電荷: 0
複雑度: 89

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)

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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.