[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane

C33H36P2 — CID 148661683

IUPAC[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane
SMILESCCCCCC/C=C(/CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C33H36P2/c1-2-3-4-5-10-27-33(35(31-23-15-8-16-24-31)32-25-17-9-18-26-32)28-34(29-19-11-6-12-20-29)30-21-13-7-14-22-30/h6-9,11-27H,2-5,10,28H2,1H3/b33-27-
InChIKeyNNXJETIQXFMXEA-KGGMANCPSA-N
MW494.60 g/mol
LogP8.11
Rot. Bonds12

About [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane

[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane (PubChem CID 148661683) has the molecular formula C33H36P2 and a molecular weight of 494.60 g/mol. Its IUPAC name is [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane.

Molecular Properties

Compound Name[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane
PubChem CID148661683
Molecular FormulaC33H36P2
Molecular Weight494.60 g/mol
Exact Mass494.23
IUPAC Name[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane
SMILESCCCCCC/C=C(/CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C33H36P2/c1-2-3-4-5-10-27-33(35(31-23-15-8-16-24-31)32-25-17-9-18-26-32)28-34(29-19-11-6-12-20-29)30-21-13-7-14-22-30/h6-9,11-27H,2-5,10,28H2,1H3/b33-27-
InChIKeyNNXJETIQXFMXEA-KGGMANCPSA-N
XLogP8.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.60
LogP ≤ 58.11
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

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2-phenylundec-2-ene-1-thiol
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[(Z)-nonadec-9-en-9-yl]sulfanylbenzene
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[(Z)-1-phenylsulfanylundec-1-enyl]benzene
CID 134932780
dodecane;phenol
CID 157210063
hexadecyl(phenyl)phosphinous acid
CID 22292084
[(Z)-1-phenylhept-1-enyl]sulfanylbenzene
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Frequently Asked Questions

What is the IUPAC name of [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane?
The IUPAC name of [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane (CID 148661683) is [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane.
What is the SMILES notation for [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane?
The canonical SMILES for [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane is CCCCCC/C=C(/CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.
What is the InChIKey of [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane?
The InChIKey is NNXJETIQXFMXEA-KGGMANCPSA-N. The full InChI is InChI=1S/C33H36P2/c1-2-3-4-5-10-27-33(35(31-23-15-8-16-24-31)32-25-17-9-18-26-32)28-34(29-19-11-6-12-20-29)30-21-13-7-14-22-30/h6-9,11-27H,2-5,10,28H2,1H3/b33-27-.
What are the key properties of [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane?
[(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane has a molecular weight of 494.60 g/mol, XLogP of 8.11, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-diphenylphosphanylnon-2-en-2-yl]-diphenylphosphane is sourced from PubChem (CID 148661683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).