[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane

C10H34P6 — CID 165019162

IUPAC[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane
SMILESC.C.C.CC(P)(P)CC(P)(P)CC(C)(P)P
InChIInChI=1S/C7H22P6.3CH4/c1-5(8,9)3-7(12,13)4-6(2,10)11;;;/h3-4,8-13H2,1-2H3;3*1H4
InChIKeyKWZCSFVNBUVIAO-UHFFFAOYSA-N
MW340.23 g/mol
LogP5.05
Rot. Bonds4

About [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane

[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane (PubChem CID 165019162) has the molecular formula C10H34P6 and a molecular weight of 340.23 g/mol. Its IUPAC name is [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane.

Molecular Properties

Compound Name[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane
PubChem CID165019162
Molecular FormulaC10H34P6
Molecular Weight340.23 g/mol
Exact Mass340.11
IUPAC Name[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane
SMILESC.C.C.CC(P)(P)CC(P)(P)CC(C)(P)P
InChIInChI=1S/C7H22P6.3CH4/c1-5(8,9)3-7(12,13)4-6(2,10)11;;;/h3-4,8-13H2,1-2H3;3*1H4
InChIKeyKWZCSFVNBUVIAO-UHFFFAOYSA-N
XLogP5.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.23
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane?
The IUPAC name of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane (CID 165019162) is [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane.
What is the SMILES notation for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane?
The canonical SMILES for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane is C.C.C.CC(P)(P)CC(P)(P)CC(C)(P)P.
What is the InChIKey of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane?
The InChIKey is KWZCSFVNBUVIAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H22P6.3CH4/c1-5(8,9)3-7(12,13)4-6(2,10)11;;;/h3-4,8-13H2,1-2H3;3*1H4.
What are the key properties of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane?
[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane has a molecular weight of 340.23 g/mol, XLogP of 5.05, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane;methane is sourced from PubChem (CID 165019162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).