Benzyltrimethylammonium acetate

HCID 13086341CAS 16969-11-2

基本情報

標準SMILES: CC(=O)[O-].C[N+](C)(C)Cc1ccccc1
InChIKey: FWYSSOIRLVHQNC-UHFFFAOYSA-M
分子式: C12H19NO2
平均分子量: 209.28 g/mol
単同位体質量: 209.14157885

名称と識別子

優先名称: Benzyltrimethylammonium acetate
IUPAC: benzyl(trimethyl)azanium acetate

名称と別名

16969-11-2benzyltrimethylammonium acetateRefChem:917011BENZYLTRIMETHYLAZANIUM ACETATEN,N,N-Trimethyl-1-phenylmethanaminium acetateSCHEMBL593316trimethyl-benzylammonium acetateDTXSID40517708HS-3288N,N,N-trimethyl-N-benzylammonium acetateN,N,N-Trimethyl(phenyl)methanaminium acetate

データベース識別子

CAS: 16969-11-2
PubChem CID: 13086341
DTXSID: DTXSID40517708

物性

構造計算による物性

極性表面積: 40.1 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: 2
重原子数: 15
形式電荷: 0
複雑度: 132

化学と産業

薬理情報

MeSH Pharmacological Classification · 2 件

Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.

Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics.