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-di(hydroxymethyl)fural|5-(hydro...

General Information

Structure

Molecular Formula

C₆H₈O₃

Molecular Mass

128.12592

Exact Mass

128.04734412

Charge

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

Calculated Properties

JChem

Acid pKa

13.417847

H Acceptors

H Donor

LogD (pH = 5.5)

-0.58120596

LogD (pH = 7.4)

-0.5812064

Log P

-0.58120596

Molar Refractivity

31.9582

Polarizability

12.16898

Polar Surface Area

53.6

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

(Fur-2,5-diyl)dimethanolFuran-2,5-diyldimethanol2,5-Bis(hydroxymethyl)furan 98+%2,5-furandimethanol2,5-bis(hydroxymethyl)fural5-(hydroxymethyl)-furfuryl alcohol2,5-Bis(hydroxymethyl)furan2,5-di(hydroxymethyl)furalFaRez 63055-(Hydroxymethyl)furfuryl AlcoholNSC 407375-(Hydroxymethyl)furfuryl AlcoholNSC 5246142,5-Di(hydroxymethyl)furan

IUPAC name

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

IUPAC Traditional name

2,5-bis(hydroxymethyl)furan

Names and Identifiers

Registration numbers

Chemspider ID

67238

CHEBI ID

59984

PubChem CID

74663