CAS 1883-75-6|(Fur-2,5-diyl)dimethanol|[5-(hydroxymethyl)furan-2-yl]methanol|Furan-2,5-diyldimethanol|2,5-bis(hydroxymethyl)furan|2,5-Bis(hydroxymethyl)furan 98+%|2,5-furandimethanol|2,5-bis(hydroxy...

基本信息

化学结构

分子式

C₆H₈O₃

分子量

128.12592

精确质量

128.04734412

电荷

InChI

InChI=1S/C6H8O3/c7-3-5-1-2-6(4-8)9-5/h1-2,7-8H,3-4H2

InChIKey

DSLRVRBSNLHVBH-UHFFFAOYSA-N

Canonic Smiles

OCc1ccc(o1)CO

Isomeric Smiles

o1c(ccc1CO)CO

计算属性

JChem

Acid pKa

13.417847

质子受体

质子供体

LogD (pH = 5.5)

-0.58120596

LogD (pH = 7.4)

-0.5812064

Log P

-0.58120596

摩尔折射率

31.9582

极化性

12.16898

极化表面积

53.6

可自由旋转的化学键

里宾斯基五规则

true

数据来源

名称和标识

别名

(Fur-2,5-diyl)dimethanolFuran-2,5-diyldimethanol2,5-Bis(hydroxymethyl)furan 98+%2,5-di(hydroxymethyl)fural5-(hydroxymethyl)-furfuryl alcohol2,5-furandimethanol2,5-Bis(hydroxymethyl)furan2,5-bis(hydroxymethyl)furalFaRez 63055-(Hydroxymethyl)furfuryl Alcohol5-(Hydroxymethyl)furfuryl AlcoholNSC 40737NSC 5246142,5-Di(hydroxymethyl)furan

IUPAC标准名

[5-(hydroxymethyl)furan-2-yl]methanol

IUPAC传统名

2,5-bis(hydroxymethyl)furan

名称和标识

数据登录号

Chemspider ID

67238

CHEBI ID

59984

PubChem CID

74663