dipropylphosphinic acid

C6H15O2P — CID 9124933

IUPACdipropylphosphinic acid
SMILESCCCP(=O)(O)CCC
InChIInChI=1S/C6H15O2P/c1-3-5-9(7,8)6-4-2/h3-6H2,1-2H3,(H,7,8)
InChIKeyWMDPJKZHARKRQI-UHFFFAOYSA-N
MW150.16 g/mol
LogP2.08
Rot. Bonds4

About dipropylphosphinic acid

dipropylphosphinic acid (PubChem CID 9124933) has the molecular formula C6H15O2P and a molecular weight of 150.16 g/mol. Its IUPAC name is dipropylphosphinic acid.

Molecular Properties

Compound Namedipropylphosphinic acid
PubChem CID9124933
Molecular FormulaC6H15O2P
Molecular Weight150.16 g/mol
Exact Mass150.08
IUPAC Namedipropylphosphinic acid
SMILESCCCP(=O)(O)CCC
InChIInChI=1S/C6H15O2P/c1-3-5-9(7,8)6-4-2/h3-6H2,1-2H3,(H,7,8)
InChIKeyWMDPJKZHARKRQI-UHFFFAOYSA-N
XLogP2.08
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.16
LogP ≤ 52.08
H-Bond Donors ≤ 51
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 dipropylphosphinic acid?
The IUPAC name of dipropylphosphinic acid (CID 9124933) is dipropylphosphinic acid.
What is the SMILES notation for dipropylphosphinic acid?
The canonical SMILES for dipropylphosphinic acid is CCCP(=O)(O)CCC.
What is the InChIKey of dipropylphosphinic acid?
The InChIKey is WMDPJKZHARKRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15O2P/c1-3-5-9(7,8)6-4-2/h3-6H2,1-2H3,(H,7,8).
What are the key properties of dipropylphosphinic acid?
dipropylphosphinic acid has a molecular weight of 150.16 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dipropylphosphinic acid is sourced from PubChem (CID 9124933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).