dicyclohexyl(6-phosphanylhexyl)phosphane

C18H36P2 — CID 151871346

IUPACdicyclohexyl(6-phosphanylhexyl)phosphane
SMILESPCCCCCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H36P2/c19-15-9-1-2-10-16-20(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h17-18H,1-16,19H2
InChIKeySMTCGKINLVLJDQ-UHFFFAOYSA-N
MW314.43 g/mol
LogP6.57
Rot. Bonds8

About dicyclohexyl(6-phosphanylhexyl)phosphane

dicyclohexyl(6-phosphanylhexyl)phosphane (PubChem CID 151871346) has the molecular formula C18H36P2 and a molecular weight of 314.43 g/mol. Its IUPAC name is dicyclohexyl(6-phosphanylhexyl)phosphane.

Molecular Properties

Compound Namedicyclohexyl(6-phosphanylhexyl)phosphane
PubChem CID151871346
Molecular FormulaC18H36P2
Molecular Weight314.43 g/mol
Exact Mass314.23
IUPAC Namedicyclohexyl(6-phosphanylhexyl)phosphane
SMILESPCCCCCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H36P2/c19-15-9-1-2-10-16-20(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h17-18H,1-16,19H2
InChIKeySMTCGKINLVLJDQ-UHFFFAOYSA-N
XLogP6.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.43
LogP ≤ 56.57
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

di(cyclobutyl)-octylphosphane
CID 151646814
dicyclohexyl-[3-[cyclohexyl(3-dicyclohexylphosphanylpropyl)phosphanyl]propyl]phosphane
CID 90108196
3-dicyclohexylphosphanylpropan-1-amine
CID 68903820
dicyclohexyl(3-cyclopenta-2,4-dien-1-ylpropyl)phosphane
CID 101105057
2-dicyclohexylphosphanylethanol
CID 154117829
2-dicyclohexylphosphanylethanamine
CID 77068327
dicyclohexyl-[[cyclohexyl(hexyl)phosphanyl]methyl]phosphane
CID 143925195
cyclohexyl-[4-[cyclohexyl(methyl)phosphanyl]butyl]-methylphosphane
CID 90057473
2-[cyclohexyl(heptyl)phosphanyl]-N-(2-dicyclohexylphosphanylethyl)ethanamine
CID 155183831
cyclohexyl(diheptyl)phosphane
CID 118892787
chloro(dihydrido)iridium;bis(2-dicyclohexylphosphanyl-N-(2-dicyclohexylphosphanylethyl)ethanamine)
CID 158559176
chloroplatinum(1+);dicyclohexyl(2-dicyclohexylphosphanylethyl)phosphane;2-methanidyl-2-methylpropane
CID 15830283

Frequently Asked Questions

What is the IUPAC name of dicyclohexyl(6-phosphanylhexyl)phosphane?
The IUPAC name of dicyclohexyl(6-phosphanylhexyl)phosphane (CID 151871346) is dicyclohexyl(6-phosphanylhexyl)phosphane.
What is the SMILES notation for dicyclohexyl(6-phosphanylhexyl)phosphane?
The canonical SMILES for dicyclohexyl(6-phosphanylhexyl)phosphane is PCCCCCCP(C1CCCCC1)C1CCCCC1.
What is the InChIKey of dicyclohexyl(6-phosphanylhexyl)phosphane?
The InChIKey is SMTCGKINLVLJDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36P2/c19-15-9-1-2-10-16-20(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h17-18H,1-16,19H2.
What are the key properties of dicyclohexyl(6-phosphanylhexyl)phosphane?
dicyclohexyl(6-phosphanylhexyl)phosphane has a molecular weight of 314.43 g/mol, XLogP of 6.57, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexyl(6-phosphanylhexyl)phosphane is sourced from PubChem (CID 151871346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).