cyclohexylphosphane

C6H13P — CID 13199

IUPACcyclohexylphosphane
SMILESPC1CCCCC1
InChIInChI=1S/C6H13P/c7-6-4-2-1-3-5-6/h6H,1-5,7H2
InChIKeyZBCKWHYWPLHBOK-UHFFFAOYSA-N
MW116.14 g/mol
LogP2.19
Rot. Bonds

About cyclohexylphosphane

cyclohexylphosphane (PubChem CID 13199) has the molecular formula C6H13P and a molecular weight of 116.14 g/mol. Its IUPAC name is cyclohexylphosphane.

Molecular Properties

Compound Namecyclohexylphosphane
PubChem CID13199
Molecular FormulaC6H13P
Molecular Weight116.14 g/mol
Exact Mass116.08
IUPAC Namecyclohexylphosphane
SMILESPC1CCCCC1
InChIInChI=1S/C6H13P/c7-6-4-2-1-3-5-6/h6H,1-5,7H2
InChIKeyZBCKWHYWPLHBOK-UHFFFAOYSA-N
XLogP2.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclohexylphosphane;gold;ruthenium
CID 159549114
carbanide;cyclopentane;cyclopentylphosphane;iron(2+)
CID 164886724
CID 59921369
CID 59921369
cyclohexylphosphane;dichloropalladium
CID 173009953
carbanide;cyclopentylphosphane;iron(2+);methane
CID 162269543
carbon monoxide;cyclohexylphosphane;bis(cyclopentane);iron;iron(2+);tetrafluoroborate
CID 23280756
cyclopentylphosphane;dichloropalladium;bis(2-methylpropane)
CID 164578408
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678
cyclohexylcycloheptane
CID 524589
cyclononylcycloicosane
CID 123187062
[4-(cyclopentylmethyl)cyclohexyl]methylcycloheptane
CID 140856779
(1R,8R)-9-methylbicyclo[6.1.0]nonane
CID 12870202

Frequently Asked Questions

What is the IUPAC name of cyclohexylphosphane?
The IUPAC name of cyclohexylphosphane (CID 13199) is cyclohexylphosphane.
What is the SMILES notation for cyclohexylphosphane?
The canonical SMILES for cyclohexylphosphane is PC1CCCCC1.
What is the InChIKey of cyclohexylphosphane?
The InChIKey is ZBCKWHYWPLHBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13P/c7-6-4-2-1-3-5-6/h6H,1-5,7H2.
What are the key properties of cyclohexylphosphane?
cyclohexylphosphane has a molecular weight of 116.14 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylphosphane is sourced from PubChem (CID 13199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).