O=C1OCCC1CCCCO
Name: 3-(4-hydroxybutyl)-dihydrofuran-2(3H)-one
SMILES: O=C1OCCC1CCCCO

Molecular Processing

Molecular formula
C8H14O3
Molecular weight
158.2
Exact mass
158.0943
XLogP
0.71
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
40

Supplementary Information

Details werden geladen…

An 4 Reaktionen beteiligt