CAS 2605-79-0|N,N-dimethyldecanamine oxide|Decylamine-N,N-Dimethyl-N-Oxide|N,N-dimethyldecanamine oxide|DDAO|N,N-Dimethyldecylamine N-oxide solution|N,N-Dimethyldecylamine N-oxide|N,N-Dimethyldecyla...

基本信息

化学结构

分子式

C₁₂H₂₇NO

分子量

201.34888

精确质量

201.20926449

电荷

InChI

InChI=1S/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3

InChIKey

ZRKZFNZPJKEWPC-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCCC[N+](C)(C)[O-]

Isomeric Smiles

[N+]([O-])(C)(C)CCCCCCCCCC

计算属性

JChem

LogD (pH = 7.4)

3.06

LogD (pH = 5.5)

3.05

Log P

3.06

可自由旋转的化学键

质子供体

质子受体

里宾斯基五规则

true

Acid pKa

4.48

极化表面积

23.06

极化性

26.88

摩尔折射率

63.51

LOG S

-3.94

数据来源

学术数据

产品目录

数据来源

名称和标识

IUPAC标准名

N,N-dimethyldecanamine oxide

别名

Decylamine-N,N-Dimethyl-N-OxideDDAON,N-Dimethyldecylamine N-oxide solutionN,N-Dimethyldecylamine N-oxideN,N-Dimethyldecylamine N-oxide solutionDetergent Screening Solution 42/Fluka kit no 66317N,N-Dimethyldecylamine N-oxide 100 mM solutionN,N-Dimethyl-1-decanamine-N-oxideDecylamine oxideN,N-dimethyldecylamine N-oxideCapric dimethyl amine oxideDecyl dimethyl amine oxidedecylamine-N,N-dimethyl-N-oxide

IUPAC传统名

N,N-dimethyldecanamine oxide decylamine oxide

名称和标识

数据登录号

PubChem SID

465069531609657922486498224864980223442547

PubChem CID

62452

MDL号

MFCD00082523

Beilstein号

2352550