CC1COc2cc(-c3ccco3)ccc2C1=O
الاسم: 7-furyl-3-methyl-4-chromanone
SMILES: CC1COc2cc(-c3ccco3)ccc2C1=O

Molecular Processing

Molecular formula
C14H12O3
Molecular weight
228.25
Exact mass
228.0786
XLogP
3.16
TPSA
39.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
63.13

Supplementary Information

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