4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol

C15H23OP — CID 118047430

IUPAC4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(Pc1ccccc1)C1CCC(O)CC1
InChIInChI=1S/C15H23OP/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h3-7,12-13,16-17H,8-11H2,1-2H3
InChIKeyQMCQQBJVGQTSCA-UHFFFAOYSA-N
MW250.32 g/mol
LogP3.32
Rot. Bonds3

About 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol

4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol (PubChem CID 118047430) has the molecular formula C15H23OP and a molecular weight of 250.32 g/mol. Its IUPAC name is 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol
PubChem CID118047430
Molecular FormulaC15H23OP
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(Pc1ccccc1)C1CCC(O)CC1
InChIInChI=1S/C15H23OP/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h3-7,12-13,16-17H,8-11H2,1-2H3
InChIKeyQMCQQBJVGQTSCA-UHFFFAOYSA-N
XLogP3.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol
CID 139824839
4-cyclopentylcyclohexan-1-ol;phenol
CID 163594426
4-tert-butylcyclohexan-1-ol;methane
CID 159612628
2-(3-hydroxycyclopentyl)-2,2-diphenylacetonitrile
CID 70880451
2-[(1R,3S)-3-hydroxycyclopentyl]-2,2-diphenylacetonitrile
CID 68601434
4-[2-(4-hydroxycyclohexyl)hexan-2-yl]cyclohexan-1-ol
CID 139753129
4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol
CID 19694020
4-[1-cyclohexyl-1-(4-hydroxycyclohexyl)ethyl]cyclohexan-1-ol
CID 20743939
acetylene;cyclohexane-1,4-diol;1,2-difluorobenzene
CID 144811099
[methoxy-bis(phenylphosphanyl)methyl]-phenylphosphane
CID 87255560
1,1'-biphenyl;cyclohexanol
CID 142137438
(2,2-dimethyl-3-phenylphosphanylpropyl)-phenylphosphane
CID 87575767

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol (CID 118047430) is 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol is CC(C)(Pc1ccccc1)C1CCC(O)CC1.
What is the InChIKey of 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol?
The InChIKey is QMCQQBJVGQTSCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23OP/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h3-7,12-13,16-17H,8-11H2,1-2H3.
What are the key properties of 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol?
4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol has a molecular weight of 250.32 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 118047430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).