Molecule

ID:111693

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₃P
Molecular Mass
198.284781
Exact Mass
198.15373737
Charge
0
InChI
InChI=1S/C12H23P/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2
InChIKey
HDULBKVLSJEMGN-UHFFFAOYSA-N
Canonic Smiles
C1CCC(CC1)PC1CCCCC1
Isomeric Smiles
C1CCC(CC1)PC1CCCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1893134
LogD (pH = 7.4)
3.200059
Log P
3.2002
Molar Refractivity
59.3234
Polarizability
24.111364
Polar Surface Area
0.0
Rotatable Bonds
2
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