1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane

C32H36P2 — CID 131733424

IUPAC1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane
SMILESC=C(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.CCCCCC
InChIInChI=1S/C26H22P2.C6H14/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;1-3-5-6-4-2/h2-21H,1H2;3-6H2,1-2H3
InChIKeyUXQDWCCIPJQWIB-UHFFFAOYSA-N
MW482.59 g/mol
LogP8.31
Rot. Bonds9

About 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane

1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane (PubChem CID 131733424) has the molecular formula C32H36P2 and a molecular weight of 482.59 g/mol. Its IUPAC name is 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane.

Molecular Properties

Compound Name1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane
PubChem CID131733424
Molecular FormulaC32H36P2
Molecular Weight482.59 g/mol
Exact Mass482.23
IUPAC Name1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane
SMILESC=C(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.CCCCCC
InChIInChI=1S/C26H22P2.C6H14/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;1-3-5-6-4-2/h2-21H,1H2;3-6H2,1-2H3
InChIKeyUXQDWCCIPJQWIB-UHFFFAOYSA-N
XLogP8.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.59
LogP ≤ 58.31
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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Related Compounds

azane;1-diphenylphosphanylethenyl(diphenyl)phosphane
CID 87633873
dipentyl(phenyl)phosphane
CID 3085487
hexadecyl(phenyl)phosphinous acid
CID 22292084
[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane
CID 148661683
heptoxy(phenyl)phosphinous acid
CID 12959801
dodecane-1-thiol;prop-1-en-2-ylbenzene
CID 157159837
oct-1-en-2-yl(triphenyl)phosphanium
CID 101022395
dodecane;phenol
CID 157210063
butyl-methyl-phenylphosphane
CID 14832966
dec-5-en-5-yl(diphenyl)phosphane;titanium(4+);tetrachloride
CID 159184721
octanoic acid;triphenylphosphane;hydrobromide
CID 173304615
butane;triphenylphosphane
CID 161447439

Frequently Asked Questions

What is the IUPAC name of 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane?
The IUPAC name of 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane (CID 131733424) is 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane.
What is the SMILES notation for 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane?
The canonical SMILES for 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane is C=C(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.CCCCCC.
What is the InChIKey of 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane?
The InChIKey is UXQDWCCIPJQWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22P2.C6H14/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;1-3-5-6-4-2/h2-21H,1H2;3-6H2,1-2H3.
What are the key properties of 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane?
1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane has a molecular weight of 482.59 g/mol, XLogP of 8.31, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-diphenylphosphanylethenyl(diphenyl)phosphane;hexane is sourced from PubChem (CID 131733424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).