methyl(propan-2-yl)phosphinic acid

C4H11O2P — CID 14440203

IUPACmethyl(propan-2-yl)phosphinic acid
SMILESCC(C)P(C)(=O)O
InChIInChI=1S/C4H11O2P/c1-4(2)7(3,5)6/h4H,1-3H3,(H,5,6)
InChIKeyDEQIVSBDZRVALM-UHFFFAOYSA-N
MW122.10 g/mol
LogP1.29
Rot. Bonds1

About methyl(propan-2-yl)phosphinic acid

methyl(propan-2-yl)phosphinic acid (PubChem CID 14440203) has the molecular formula C4H11O2P and a molecular weight of 122.10 g/mol. Its IUPAC name is methyl(propan-2-yl)phosphinic acid.

Molecular Properties

Compound Namemethyl(propan-2-yl)phosphinic acid
PubChem CID14440203
Molecular FormulaC4H11O2P
Molecular Weight122.10 g/mol
Exact Mass122.05
IUPAC Namemethyl(propan-2-yl)phosphinic acid
SMILESCC(C)P(C)(=O)O
InChIInChI=1S/C4H11O2P/c1-4(2)7(3,5)6/h4H,1-3H3,(H,5,6)
InChIKeyDEQIVSBDZRVALM-UHFFFAOYSA-N
XLogP1.29
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.10
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze methyl(propan-2-yl)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 methyl(propan-2-yl)phosphinic acid?
The IUPAC name of methyl(propan-2-yl)phosphinic acid (CID 14440203) is methyl(propan-2-yl)phosphinic acid.
What is the SMILES notation for methyl(propan-2-yl)phosphinic acid?
The canonical SMILES for methyl(propan-2-yl)phosphinic acid is CC(C)P(C)(=O)O.
What is the InChIKey of methyl(propan-2-yl)phosphinic acid?
The InChIKey is DEQIVSBDZRVALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O2P/c1-4(2)7(3,5)6/h4H,1-3H3,(H,5,6).
What are the key properties of methyl(propan-2-yl)phosphinic acid?
methyl(propan-2-yl)phosphinic acid has a molecular weight of 122.10 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(propan-2-yl)phosphinic acid is sourced from PubChem (CID 14440203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).