methyl(propan-2-yloxy)phosphinic acid

C4H11O3P — CID 15778

IUPACmethyl(propan-2-yloxy)phosphinic acid
SMILESCC(C)OP(C)(=O)O
InChIInChI=1S/C4H11O3P/c1-4(2)7-8(3,5)6/h4H,1-3H3,(H,5,6)
InChIKeyGHZKGHQGPXBWSN-UHFFFAOYSA-N
MW138.10 g/mol
LogP1.23
Rot. Bonds2

About methyl(propan-2-yloxy)phosphinic acid

methyl(propan-2-yloxy)phosphinic acid (PubChem CID 15778) has the molecular formula C4H11O3P and a molecular weight of 138.10 g/mol. Its IUPAC name is methyl(propan-2-yloxy)phosphinic acid.

Molecular Properties

Compound Namemethyl(propan-2-yloxy)phosphinic acid
PubChem CID15778
Molecular FormulaC4H11O3P
Molecular Weight138.10 g/mol
Exact Mass138.04
IUPAC Namemethyl(propan-2-yloxy)phosphinic acid
SMILESCC(C)OP(C)(=O)O
InChIInChI=1S/C4H11O3P/c1-4(2)7-8(3,5)6/h4H,1-3H3,(H,5,6)
InChIKeyGHZKGHQGPXBWSN-UHFFFAOYSA-N
XLogP1.23
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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'}

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Frequently Asked Questions

What is the IUPAC name of methyl(propan-2-yloxy)phosphinic acid?
The IUPAC name of methyl(propan-2-yloxy)phosphinic acid (CID 15778) is methyl(propan-2-yloxy)phosphinic acid.
What is the SMILES notation for methyl(propan-2-yloxy)phosphinic acid?
The canonical SMILES for methyl(propan-2-yloxy)phosphinic acid is CC(C)OP(C)(=O)O.
What is the InChIKey of methyl(propan-2-yloxy)phosphinic acid?
The InChIKey is GHZKGHQGPXBWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O3P/c1-4(2)7-8(3,5)6/h4H,1-3H3,(H,5,6).
What are the key properties of methyl(propan-2-yloxy)phosphinic acid?
methyl(propan-2-yloxy)phosphinic acid has a molecular weight of 138.10 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(propan-2-yloxy)phosphinic acid is sourced from PubChem (CID 15778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).