N-(2-ethoxy-2-oxoethyl)-N,N-dimethylhexadecan-1-aminium chloride

HCID 22761786CAS 16535-55-0

基本情報

標準SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)OCC.[Cl-]
InChIKey: DCZOTHMWVAIKSD-UHFFFAOYSA-M
分子式: C22H46ClNO2
平均分子量: 392.1 g/mol
単同位体質量: 391.32170739

名称と識別子

優先名称: N-(2-ethoxy-2-oxoethyl)-N,N-dimethylhexadecan-1-aminium chloride
IUPAC: (2-ethoxy-2-oxoethyl)-hexadecyl-dimethylazanium chloride

名称と別名

16535-55-0DTXSID00628203N-(2-Ethoxy-2-oxoethyl)-N,N-dimethylhexadecan-1-aminium chlorideRefChem:825304DTXCID00578956605-404-6SCHEMBL11655846DCZOTHMWVAIKSD-UHFFFAOYSA-MAKOS024353584NS00025412ST50979732Carboethoxymethyl-dimethyl-cetyl-ammonium chloride

名称をさらに表示

ethyl 2-(hexadecyldimethylamino)acetate, chlorideCarboethoxymethyl-dimethyl-cetyl -ammonium chloride

データベース識別子

CAS: 16535-55-0
PubChem CID: 22761786
DTXSID: DTXSID00628203
EC Number: 605-404-6

物性

構造計算による物性

極性表面積: 26.3 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 19
重原子数: 26
形式電荷: 0
複雑度: 302

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

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

危険有害性情報

Regulatory InformationStatus: Active Update: 30-07-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/29590

Hazard Classes and CategoriesEye Irrit. 2 (100%)