Molecule

ID:128255

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₄O
Molecular Mass
150.21756
Exact Mass
150.10446507
Charge
0
InChI
InChI=1S/C10H14O/c1-7-3-4-9-8(2)6-11-10(9)5-7/h6-7H,3-5H2,1-2H3
InChIKey
YGWKXXYGDYYFJU-UHFFFAOYSA-N
Canonic Smiles
CC1CCc2c(C1)occ2C
Isomeric Smiles
o1c2c(c(c1)C)CCC(C2)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1302798
LogD (pH = 7.4)
3.1302798
Log P
3.1302798
Molar Refractivity
45.6749
Polarizability
17.277023
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
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation