Molecule

ID:84883

General Information
Structure
MolImage
Molecular Formula
C₉H₈O
Molecular Mass
132.15922
Exact Mass
132.05751488
Charge
0
InChI
InChI=1S/C9H8O/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6H,1H3
InChIKey
ZRXHLJNBNWVNIM-UHFFFAOYSA-N
Canonic Smiles
Cc1coc2c1cccc2
Isomeric Smiles
o1cc(c2c1cccc2)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6457906
LogD (pH = 7.4)
2.6457906
Log P
2.6457906
Molar Refractivity
39.9403
Polarizability
16.532063
Polar Surface Area
13.14
Rotatable Bonds
0
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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