methyl(methylsulfanyloxy)phosphinic acid

C2H7O3PS — CID 154029046

IUPACmethyl(methylsulfanyloxy)phosphinic acid
SMILESCSOP(C)(=O)O
InChIInChI=1S/C2H7O3PS/c1-6(3,4)5-7-2/h1-2H3,(H,3,4)
InChIKeyVWQOOMNZYORGHE-UHFFFAOYSA-N
MW142.12 g/mol
LogP1.10
Rot. Bonds2

About methyl(methylsulfanyloxy)phosphinic acid

methyl(methylsulfanyloxy)phosphinic acid (PubChem CID 154029046) has the molecular formula C2H7O3PS and a molecular weight of 142.12 g/mol. Its IUPAC name is methyl(methylsulfanyloxy)phosphinic acid.

Molecular Properties

Compound Namemethyl(methylsulfanyloxy)phosphinic acid
PubChem CID154029046
Molecular FormulaC2H7O3PS
Molecular Weight142.12 g/mol
Exact Mass141.99
IUPAC Namemethyl(methylsulfanyloxy)phosphinic acid
SMILESCSOP(C)(=O)O
InChIInChI=1S/C2H7O3PS/c1-6(3,4)5-7-2/h1-2H3,(H,3,4)
InChIKeyVWQOOMNZYORGHE-UHFFFAOYSA-N
XLogP1.10
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl(methylsulfanyloxy)phosphinic acid?
The IUPAC name of methyl(methylsulfanyloxy)phosphinic acid (CID 154029046) is methyl(methylsulfanyloxy)phosphinic acid.
What is the SMILES notation for methyl(methylsulfanyloxy)phosphinic acid?
The canonical SMILES for methyl(methylsulfanyloxy)phosphinic acid is CSOP(C)(=O)O.
What is the InChIKey of methyl(methylsulfanyloxy)phosphinic acid?
The InChIKey is VWQOOMNZYORGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7O3PS/c1-6(3,4)5-7-2/h1-2H3,(H,3,4).
What are the key properties of methyl(methylsulfanyloxy)phosphinic acid?
methyl(methylsulfanyloxy)phosphinic acid has a molecular weight of 142.12 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(methylsulfanyloxy)phosphinic acid is sourced from PubChem (CID 154029046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).