1-(phosphinan-1-yloxy)phosphinane

C10H20OP2 — CID 88785849

IUPAC1-(phosphinan-1-yloxy)phosphinane
SMILESC1CCP(OP2CCCCC2)CC1
InChIInChI=1S/C10H20OP2/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H2
InChIKeyVCABRICPGUNCFO-UHFFFAOYSA-N
MW218.22 g/mol
LogP4.16
Rot. Bonds2

About 1-(phosphinan-1-yloxy)phosphinane

1-(phosphinan-1-yloxy)phosphinane (PubChem CID 88785849) has the molecular formula C10H20OP2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 1-(phosphinan-1-yloxy)phosphinane.

Molecular Properties

Compound Name1-(phosphinan-1-yloxy)phosphinane
PubChem CID88785849
Molecular FormulaC10H20OP2
Molecular Weight218.22 g/mol
Exact Mass218.10
IUPAC Name1-(phosphinan-1-yloxy)phosphinane
SMILESC1CCP(OP2CCCCC2)CC1
InChIInChI=1S/C10H20OP2/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H2
InChIKeyVCABRICPGUNCFO-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(phosphinan-1-yloxy)phosphinane?
The IUPAC name of 1-(phosphinan-1-yloxy)phosphinane (CID 88785849) is 1-(phosphinan-1-yloxy)phosphinane.
What is the SMILES notation for 1-(phosphinan-1-yloxy)phosphinane?
The canonical SMILES for 1-(phosphinan-1-yloxy)phosphinane is C1CCP(OP2CCCCC2)CC1.
What is the InChIKey of 1-(phosphinan-1-yloxy)phosphinane?
The InChIKey is VCABRICPGUNCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OP2/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H2.
What are the key properties of 1-(phosphinan-1-yloxy)phosphinane?
1-(phosphinan-1-yloxy)phosphinane has a molecular weight of 218.22 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(phosphinan-1-yloxy)phosphinane is sourced from PubChem (CID 88785849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).