1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane

C16H36P2 — CID 126613781

IUPAC1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane
SMILESCCC(CP(C(C)C)C(C)C)P(C(C)C)C(C)C
InChIInChI=1S/C16H36P2/c1-10-16(18(14(6)7)15(8)9)11-17(12(2)3)13(4)5/h12-16H,10-11H2,1-9H3
InChIKeyMSNLHDRROZNPCA-UHFFFAOYSA-N
MW290.41 g/mol
LogP6.36
Rot. Bonds8

About 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane

1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane (PubChem CID 126613781) has the molecular formula C16H36P2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane.

Molecular Properties

Compound Name1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane
PubChem CID126613781
Molecular FormulaC16H36P2
Molecular Weight290.41 g/mol
Exact Mass290.23
IUPAC Name1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane
SMILESCCC(CP(C(C)C)C(C)C)P(C(C)C)C(C)C
InChIInChI=1S/C16H36P2/c1-10-16(18(14(6)7)15(8)9)11-17(12(2)3)13(4)5/h12-16H,10-11H2,1-9H3
InChIKeyMSNLHDRROZNPCA-UHFFFAOYSA-N
XLogP6.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 56.36
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

(2R,3R)-2,3-dichloropentane
CID 6431009
palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide
CID 175774543
2-methylbutane
CID 159175971
2-methylbutane
CID 158117812
bis(2-di(propan-2-yl)phosphanylethyl-di(propan-2-yl)phosphane);bis(rhodium)
CID 10952707
chlororuthenium;tris(tri(propan-2-yl)phosphane)
CID 173316351
carbon monoxide;osmium;bis(tri(propan-2-yl)phosphane)
CID 11444122
dibromonickel;bis(tri(propan-2-yl)phosphane)
CID 88800949
1-[bis(2-methylpropyl)phosphanyl]propyl-bis(2-methylpropyl)phosphane
CID 87563384
2-methylbutane;nickel
CID 159021520
2-methylbutane;yttrium
CID 157105537
butane;ethane;methanol;2-methylbutane
CID 170758487

Frequently Asked Questions

What is the IUPAC name of 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane?
The IUPAC name of 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane (CID 126613781) is 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane.
What is the SMILES notation for 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane?
The canonical SMILES for 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane is CCC(CP(C(C)C)C(C)C)P(C(C)C)C(C)C.
What is the InChIKey of 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane?
The InChIKey is MSNLHDRROZNPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36P2/c1-10-16(18(14(6)7)15(8)9)11-17(12(2)3)13(4)5/h12-16H,10-11H2,1-9H3.
What are the key properties of 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane?
1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane has a molecular weight of 290.41 g/mol, XLogP of 6.36, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-di(propan-2-yl)phosphanylbutan-2-yl-di(propan-2-yl)phosphane is sourced from PubChem (CID 126613781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).