methoxy(oxaldehydoyl)phosphinic acid

C3H5O5P — CID 87673316

IUPACmethoxy(oxaldehydoyl)phosphinic acid
SMILESCOP(=O)(O)C(=O)C=O
InChIInChI=1S/C3H5O5P/c1-8-9(6,7)3(5)2-4/h2H,1H3,(H,6,7)
InChIKeyCPANFCSRXQSWQC-UHFFFAOYSA-N
MW152.04 g/mol
LogP-0.46
Rot. Bonds3

About methoxy(oxaldehydoyl)phosphinic acid

methoxy(oxaldehydoyl)phosphinic acid (PubChem CID 87673316) has the molecular formula C3H5O5P and a molecular weight of 152.04 g/mol. Its IUPAC name is methoxy(oxaldehydoyl)phosphinic acid.

Molecular Properties

Compound Namemethoxy(oxaldehydoyl)phosphinic acid
PubChem CID87673316
Molecular FormulaC3H5O5P
Molecular Weight152.04 g/mol
Exact Mass151.99
IUPAC Namemethoxy(oxaldehydoyl)phosphinic acid
SMILESCOP(=O)(O)C(=O)C=O
InChIInChI=1S/C3H5O5P/c1-8-9(6,7)3(5)2-4/h2H,1H3,(H,6,7)
InChIKeyCPANFCSRXQSWQC-UHFFFAOYSA-N
XLogP-0.46
TPSA80.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.04
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

trihydroxy-[hydroxy(methoxy)phosphoryl]carbonylphosphanium
CID 56626308
(E)-1-dimethoxyphosphoryl-2-methylbut-2-en-1-one
CID 101018337
carbanylium;methyl dihydrogen phosphate
CID 165007935
methyl dihydrogen phosphate;prop-2-enoic acid
CID 159593084
tris(dimethyl hydrogen phosphate);titanium
CID 131876605
cobalt;methyl dihydrogen phosphate;nickel
CID 175031346
fluoro(methoxy)phosphinic acid
CID 23235630
oxaldehydic acid;phosphoric acid
CID 161389522
formaldehyde;bis(methyl dihydrogen phosphate)
CID 174780160
dipotassium;hydride;methyl dihydrogen phosphate
CID 174980148
dimethyl hydrogen phosphate;heptahydrate
CID 175149976
dimethyl hydrogen phosphate;methane
CID 88807117

Frequently Asked Questions

What is the IUPAC name of methoxy(oxaldehydoyl)phosphinic acid?
The IUPAC name of methoxy(oxaldehydoyl)phosphinic acid (CID 87673316) is methoxy(oxaldehydoyl)phosphinic acid.
What is the SMILES notation for methoxy(oxaldehydoyl)phosphinic acid?
The canonical SMILES for methoxy(oxaldehydoyl)phosphinic acid is COP(=O)(O)C(=O)C=O.
What is the InChIKey of methoxy(oxaldehydoyl)phosphinic acid?
The InChIKey is CPANFCSRXQSWQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5O5P/c1-8-9(6,7)3(5)2-4/h2H,1H3,(H,6,7).
What are the key properties of methoxy(oxaldehydoyl)phosphinic acid?
methoxy(oxaldehydoyl)phosphinic acid has a molecular weight of 152.04 g/mol, XLogP of -0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(oxaldehydoyl)phosphinic acid is sourced from PubChem (CID 87673316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).