phosphanyl(propoxy)phosphane

C3H10OP2 — CID 140635159

IUPACphosphanyl(propoxy)phosphane
SMILESCCCOPP
InChIInChI=1S/C3H10OP2/c1-2-3-4-6-5/h6H,2-3,5H2,1H3
InChIKeyVZBXJHTWTGJGAH-UHFFFAOYSA-N
MW124.06 g/mol
LogP1.80
Rot. Bonds3

About phosphanyl(propoxy)phosphane

phosphanyl(propoxy)phosphane (PubChem CID 140635159) has the molecular formula C3H10OP2 and a molecular weight of 124.06 g/mol. Its IUPAC name is phosphanyl(propoxy)phosphane.

Molecular Properties

Compound Namephosphanyl(propoxy)phosphane
PubChem CID140635159
Molecular FormulaC3H10OP2
Molecular Weight124.06 g/mol
Exact Mass124.02
IUPAC Namephosphanyl(propoxy)phosphane
SMILESCCCOPP
InChIInChI=1S/C3H10OP2/c1-2-3-4-6-5/h6H,2-3,5H2,1H3
InChIKeyVZBXJHTWTGJGAH-UHFFFAOYSA-N
XLogP1.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.06
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphanyl(propoxy)phosphane?
The IUPAC name of phosphanyl(propoxy)phosphane (CID 140635159) is phosphanyl(propoxy)phosphane.
What is the SMILES notation for phosphanyl(propoxy)phosphane?
The canonical SMILES for phosphanyl(propoxy)phosphane is CCCOPP.
What is the InChIKey of phosphanyl(propoxy)phosphane?
The InChIKey is VZBXJHTWTGJGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10OP2/c1-2-3-4-6-5/h6H,2-3,5H2,1H3.
What are the key properties of phosphanyl(propoxy)phosphane?
phosphanyl(propoxy)phosphane has a molecular weight of 124.06 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phosphanyl(propoxy)phosphane is sourced from PubChem (CID 140635159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).