[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane

C26H25P — CID 155147383

IUPAC[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane
SMILESPc1ccc2ccccc2c1-c1c(C2CCCCC2)ccc2ccccc12
InChIInChI=1S/C26H25P/c27-24-17-15-20-11-5-7-13-22(20)26(24)25-21-12-6-4-10-19(21)14-16-23(25)18-8-2-1-3-9-18/h4-7,10-18H,1-3,8-9,27H2
InChIKeyPAFOTBJTPIFONN-UHFFFAOYSA-N
MW368.46 g/mol
LogP7.21
Rot. Bonds2

About [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane

[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane (PubChem CID 155147383) has the molecular formula C26H25P and a molecular weight of 368.46 g/mol. Its IUPAC name is [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane.

Molecular Properties

Compound Name[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane
PubChem CID155147383
Molecular FormulaC26H25P
Molecular Weight368.46 g/mol
Exact Mass368.17
IUPAC Name[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane
SMILESPc1ccc2ccccc2c1-c1c(C2CCCCC2)ccc2ccccc12
InChIInChI=1S/C26H25P/c27-24-17-15-20-11-5-7-13-22(20)26(24)25-21-12-6-4-10-19(21)14-16-23(25)18-8-2-1-3-9-18/h4-7,10-18H,1-3,8-9,27H2
InChIKeyPAFOTBJTPIFONN-UHFFFAOYSA-N
XLogP7.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.46
LogP ≤ 57.21
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 [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane?
The IUPAC name of [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane (CID 155147383) is [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane.
What is the SMILES notation for [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane?
The canonical SMILES for [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane is Pc1ccc2ccccc2c1-c1c(C2CCCCC2)ccc2ccccc12.
What is the InChIKey of [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane?
The InChIKey is PAFOTBJTPIFONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25P/c27-24-17-15-20-11-5-7-13-22(20)26(24)25-21-12-6-4-10-19(21)14-16-23(25)18-8-2-1-3-9-18/h4-7,10-18H,1-3,8-9,27H2.
What are the key properties of [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane?
[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane has a molecular weight of 368.46 g/mol, XLogP of 7.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane is sourced from PubChem (CID 155147383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).