methoxy(propyl)phosphinic acid

C4H11O3P — CID 3041195

IUPACmethoxy(propyl)phosphinic acid
SMILESCCCP(=O)(O)OC
InChIInChI=1S/C4H11O3P/c1-3-4-8(5,6)7-2/h3-4H2,1-2H3,(H,5,6)
InChIKeyRLDXWNAZJDJGCX-UHFFFAOYSA-N
MW138.10 g/mol
LogP1.23
Rot. Bonds3

About methoxy(propyl)phosphinic acid

methoxy(propyl)phosphinic acid (PubChem CID 3041195) has the molecular formula C4H11O3P and a molecular weight of 138.10 g/mol. Its IUPAC name is methoxy(propyl)phosphinic acid.

Molecular Properties

Compound Namemethoxy(propyl)phosphinic acid
PubChem CID3041195
Molecular FormulaC4H11O3P
Molecular Weight138.10 g/mol
Exact Mass138.04
IUPAC Namemethoxy(propyl)phosphinic acid
SMILESCCCP(=O)(O)OC
InChIInChI=1S/C4H11O3P/c1-3-4-8(5,6)7-2/h3-4H2,1-2H3,(H,5,6)
InChIKeyRLDXWNAZJDJGCX-UHFFFAOYSA-N
XLogP1.23
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.10
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze methoxy(propyl)phosphinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methoxy(propyl)phosphinic acid?
The IUPAC name of methoxy(propyl)phosphinic acid (CID 3041195) is methoxy(propyl)phosphinic acid.
What is the SMILES notation for methoxy(propyl)phosphinic acid?
The canonical SMILES for methoxy(propyl)phosphinic acid is CCCP(=O)(O)OC.
What is the InChIKey of methoxy(propyl)phosphinic acid?
The InChIKey is RLDXWNAZJDJGCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O3P/c1-3-4-8(5,6)7-2/h3-4H2,1-2H3,(H,5,6).
What are the key properties of methoxy(propyl)phosphinic acid?
methoxy(propyl)phosphinic acid has a molecular weight of 138.10 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(propyl)phosphinic acid is sourced from PubChem (CID 3041195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).