C=CCC1=CC(=CC(=C1O)CC=C)C=O
Name: 4-hydroxy-3,5-bis(prop-2-enyl)benzaldehyde
SMILES: C=CCC1=CC(=CC(=C1O)CC=C)C=O

Molecular Processing

Molecular formula
C13H14O2
Molecular weight
202.25
Exact mass
202.0994
XLogP
2.66
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
61.3

Supplementary Information

InChIKey: MMNDXXBXDUWNPG-UHFFFAOYSA-N
Synonyme
SCHEMBL1001855SCHEMBL10493469MMNDXXBXDUWNPG-UHFFFAOYSA-N3,5-di-(2-propenyl)-4-hydroxybenzaldehyde
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