dipentyl-(2-phenylphenyl)phosphane

C22H31P — CID 67449535

IUPACdipentyl-(2-phenylphenyl)phosphane
SMILESCCCCCP(CCCCC)c1ccccc1-c1ccccc1
InChIInChI=1S/C22H31P/c1-3-5-12-18-23(19-13-6-4-2)22-17-11-10-16-21(22)20-14-8-7-9-15-20/h7-11,14-17H,3-6,12-13,18-19H2,1-2H3
InChIKeyHUKKPAVJVHBDQG-UHFFFAOYSA-N
MW326.46 g/mol
LogP6.84
Rot. Bonds10

About dipentyl-(2-phenylphenyl)phosphane

dipentyl-(2-phenylphenyl)phosphane (PubChem CID 67449535) has the molecular formula C22H31P and a molecular weight of 326.46 g/mol. Its IUPAC name is dipentyl-(2-phenylphenyl)phosphane.

Molecular Properties

Compound Namedipentyl-(2-phenylphenyl)phosphane
PubChem CID67449535
Molecular FormulaC22H31P
Molecular Weight326.46 g/mol
Exact Mass326.22
IUPAC Namedipentyl-(2-phenylphenyl)phosphane
SMILESCCCCCP(CCCCC)c1ccccc1-c1ccccc1
InChIInChI=1S/C22H31P/c1-3-5-12-18-23(19-13-6-4-2)22-17-11-10-16-21(22)20-14-8-7-9-15-20/h7-11,14-17H,3-6,12-13,18-19H2,1-2H3
InChIKeyHUKKPAVJVHBDQG-UHFFFAOYSA-N
XLogP6.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.46
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dipentyl-(2-phenylphenyl)phosphane?
The IUPAC name of dipentyl-(2-phenylphenyl)phosphane (CID 67449535) is dipentyl-(2-phenylphenyl)phosphane.
What is the SMILES notation for dipentyl-(2-phenylphenyl)phosphane?
The canonical SMILES for dipentyl-(2-phenylphenyl)phosphane is CCCCCP(CCCCC)c1ccccc1-c1ccccc1.
What is the InChIKey of dipentyl-(2-phenylphenyl)phosphane?
The InChIKey is HUKKPAVJVHBDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31P/c1-3-5-12-18-23(19-13-6-4-2)22-17-11-10-16-21(22)20-14-8-7-9-15-20/h7-11,14-17H,3-6,12-13,18-19H2,1-2H3.
What are the key properties of dipentyl-(2-phenylphenyl)phosphane?
dipentyl-(2-phenylphenyl)phosphane has a molecular weight of 326.46 g/mol, XLogP of 6.84, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dipentyl-(2-phenylphenyl)phosphane is sourced from PubChem (CID 67449535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).