General
Preferred name
PD158331
Synonyms
2-Acetylfuran ()
2-Furyl methyl ketone ()
P&D ID
PD158331
CAS
1192-62-7
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION 2-Acetylfuran (2-Furyl methyl ketone), an important flavour compound or intermediate in foods, is isolated from essential oils, sweet corn products, fruits and flowers. 2-Acetylfuran also can be formed from glucose and glycine by Maillard reaction. 2-Acetylfuran can be used to synthesis Cefuroxime. 2-acetylfuran can be used in the synthesis of reagents with antiamoebic activity[1][2][3].
Compound Sets
1
MedChem Express Bioactive Compound Library
HY-W015912
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
110.04
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.48
TPSA
30.21
Fraction CSP3
0.17
Chiral centers
0.0
Largest ring
5.0
QED
0.51
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Drug intermediate
Source data