CAS 6098-44-8|Acetoxy AAF|<i>N</i>-Acetoxy-2-acetamidofluorene|acetoxyacetylaminofluorene|<i>N</i>-Acetoxy-2-acetylaminofluorene|Acetoxyfluorenylacetamide;|Acetoxyacetamidofluorene|Acetoxyacetylamin...

基本信息

化学结构

分子式

C₁₇H₁₅NO₃

分子量

281.3059

精确质量

281.10519335

电荷

InChI

InChI=1S/C17H15NO3/c1-11(19)18(21-12(2)20)15-7-8-17-14(10-15)9-13-5-3-4-6-16(13)17/h3-8,10H,9H2,1-2H3

InChIKey

NFOMHWALMFWNAQ-UHFFFAOYSA-N

Canonic Smiles

CC(=O)ON(c1ccc2-c3c(Cc2c1)cccc3)C(=O)C

Isomeric Smiles

CC(=O)ON(C(=O)C)c1ccc2c(Cc3ccccc23)c1

计算属性

JChem

LogD (pH = 7.4)

2.76

LogD (pH = 5.5)

2.76

Log P

2.76

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

15.41

极化表面积

46.61

极化性

30.00

摩尔折射率

78.87

LOG S

-4.28

数据来源

学术数据

Wikipedia

Acetoxyacetylaminofluorene

数据来源

名称和标识

别名

Acetoxy AAFN-Acetoxy-2-acetamidofluoreneN-Acetoxy-2-acetylaminofluoreneAcetoxyfluorenylacetamide;AcetoxyacetamidofluoreneAcetoxyacetylaminofluoreneNAAAFN-(Acetoxy)-N-9H-fluoren-2-ylacetamideN-(Fluoren-2-yl)acetohydroxamic acetateAcetoxy AAFN-Acetoxy-N-2-fluorenylacetamideNA-AAF2-AcetoxyacetylaminofluoreneN-Acetoxy-N-acetyl-2-aminofluoreneN-Acetoxy-2-fluorenylacetamideN-acetoxy-2-acetamidofluoreneAcetic acid, (N-acetyl-N-(2-fluorenyl)amino) esterAcetic acid, ester with N-(fluoren-2-yl)acetohydroxamic acidN-(Fluoren-2-yl)acetohydroxamic acetamideAcetoxyacetylaminofluoreneN-Acetoxy-2-acetaminofluorene

IUPAC传统名

acetoxyacetylaminofluorene

IUPAC标准名

N-(9H-fluoren-2-yl)acetamido acetate

名称和标识

数据登录号

CHEBI ID

234426CHEBI:76331

PubChem CID

22469

Chemspider ID

21074