Molecule

ID:106802

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₀O
Molecular Mass
146.1858
Exact Mass
146.07316494
Charge
0
InChI
InChI=1S/C10H10O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-8H,1H3
InChIKey
VLUMOWNVWOXZAU-UHFFFAOYSA-N
Canonic Smiles
O=C/C(=C/c1ccccc1)/C
Isomeric Smiles
C/C(=C\c1ccccc1)/C=O
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.3730204
LogD (pH = 7.4)
2.3730204
Log P
2.3730204
Molar Refractivity
46.4916
Polarizability
17.6281
Polar Surface Area
17.07
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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