tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane

C32H72P2 — CID 173272787

IUPACtetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane
SMILESCCCCP(CCCC)(CCCC)(CCCC)P(CCCC)(CCCC)(CCCC)CCCC
InChIInChI=1S/C32H72P2/c1-9-17-25-33(26-18-10-2,27-19-11-3,28-20-12-4)34(29-21-13-5,30-22-14-6,31-23-15-7)32-24-16-8/h9-32H2,1-8H3
InChIKeyQTRRNVQGIYOBCH-UHFFFAOYSA-N
MW518.88 g/mol
LogP12.41
Rot. Bonds25

About tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane

tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane (PubChem CID 173272787) has the molecular formula C32H72P2 and a molecular weight of 518.88 g/mol. Its IUPAC name is tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane.

Molecular Properties

Compound Nametetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane
PubChem CID173272787
Molecular FormulaC32H72P2
Molecular Weight518.88 g/mol
Exact Mass518.51
IUPAC Nametetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane
SMILESCCCCP(CCCC)(CCCC)(CCCC)P(CCCC)(CCCC)(CCCC)CCCC
InChIInChI=1S/C32H72P2/c1-9-17-25-33(26-18-10-2,27-19-11-3,28-20-12-4)34(29-21-13-5,30-22-14-6,31-23-15-7)32-24-16-8/h9-32H2,1-8H3
InChIKeyQTRRNVQGIYOBCH-UHFFFAOYSA-N
XLogP12.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds25
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.88
LogP ≤ 512.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

manganese;tetracosane
CID 175605770
molecular hydrogen;pentane
CID 173460731
hexakis(decane);manganese
CID 173234782
butyl-trihydroxy-methyl-λ5-phosphane
CID 87283068
tetrabutyl(fluoro)-lambda5-phosphane;dihydrofluoride
CID 14950742
bromo-dibutyl-dipentyl-λ5-phosphane
CID 140528033
iodo-dipentyl-di(tetradecyl)-λ5-phosphane
CID 140527954
butyl-triethyl-iodo-λ5-phosphane
CID 140527989
hydroxysilane;tetrabutyl(hydroxy)-λ5-phosphane
CID 160702804
triheptyl-iodo-octyl-λ5-phosphane
CID 140527558
sodium;dibutyl(trihydroxy)-λ5-phosphane;hydride
CID 173127559
dibutyl-chloro-dipropyl-λ5-phosphane
CID 140527658

Frequently Asked Questions

What is the IUPAC name of tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane?
The IUPAC name of tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane (CID 173272787) is tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane.
What is the SMILES notation for tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane?
The canonical SMILES for tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane is CCCCP(CCCC)(CCCC)(CCCC)P(CCCC)(CCCC)(CCCC)CCCC.
What is the InChIKey of tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane?
The InChIKey is QTRRNVQGIYOBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H72P2/c1-9-17-25-33(26-18-10-2,27-19-11-3,28-20-12-4)34(29-21-13-5,30-22-14-6,31-23-15-7)32-24-16-8/h9-32H2,1-8H3.
What are the key properties of tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane?
tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane has a molecular weight of 518.88 g/mol, XLogP of 12.41, 25 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrabutyl-(tetrabutyl-λ5-phosphanyl)-λ5-phosphane is sourced from PubChem (CID 173272787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).