cyclohexylmethyl(naphthalen-1-yl)phosphane

C17H21P — CID 167150287

IUPACcyclohexylmethyl(naphthalen-1-yl)phosphane
SMILESc1ccc2c(PCC3CCCCC3)cccc2c1
InChIInChI=1S/C17H21P/c1-2-7-14(8-3-1)13-18-17-12-6-10-15-9-4-5-11-16(15)17/h4-6,9-12,14,18H,1-3,7-8,13H2
InChIKeyZDFLHYZFMRUIRY-UHFFFAOYSA-N
MW256.33 g/mol
LogP4.72
Rot. Bonds3

About cyclohexylmethyl(naphthalen-1-yl)phosphane

cyclohexylmethyl(naphthalen-1-yl)phosphane (PubChem CID 167150287) has the molecular formula C17H21P and a molecular weight of 256.33 g/mol. Its IUPAC name is cyclohexylmethyl(naphthalen-1-yl)phosphane.

Molecular Properties

Compound Namecyclohexylmethyl(naphthalen-1-yl)phosphane
PubChem CID167150287
Molecular FormulaC17H21P
Molecular Weight256.33 g/mol
Exact Mass256.14
IUPAC Namecyclohexylmethyl(naphthalen-1-yl)phosphane
SMILESc1ccc2c(PCC3CCCCC3)cccc2c1
InChIInChI=1S/C17H21P/c1-2-7-14(8-3-1)13-18-17-12-6-10-15-9-4-5-11-16(15)17/h4-6,9-12,14,18H,1-3,7-8,13H2
InChIKeyZDFLHYZFMRUIRY-UHFFFAOYSA-N
XLogP4.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexylmethyl(naphthalen-1-yl)phosphane?
The IUPAC name of cyclohexylmethyl(naphthalen-1-yl)phosphane (CID 167150287) is cyclohexylmethyl(naphthalen-1-yl)phosphane.
What is the SMILES notation for cyclohexylmethyl(naphthalen-1-yl)phosphane?
The canonical SMILES for cyclohexylmethyl(naphthalen-1-yl)phosphane is c1ccc2c(PCC3CCCCC3)cccc2c1.
What is the InChIKey of cyclohexylmethyl(naphthalen-1-yl)phosphane?
The InChIKey is ZDFLHYZFMRUIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21P/c1-2-7-14(8-3-1)13-18-17-12-6-10-15-9-4-5-11-16(15)17/h4-6,9-12,14,18H,1-3,7-8,13H2.
What are the key properties of cyclohexylmethyl(naphthalen-1-yl)phosphane?
cyclohexylmethyl(naphthalen-1-yl)phosphane has a molecular weight of 256.33 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl(naphthalen-1-yl)phosphane is sourced from PubChem (CID 167150287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).