COc1cc(C=C2CCCC2=O)cc(OC)c1OC
Name: 2-(3,4,5-trimethoxybenzylidene)cyclopentanone
SMILES: COc1cc(C=C2CCCC2=O)cc(OC)c1OC

Molecular Processing

Molecular formula
C15H18O4
Molecular weight
262.3
Exact mass
262.1205
XLogP
2.85
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
72.93

Supplementary Information

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