[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid

C3H10O6P2 — CID 20756088

IUPAC[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid
SMILESCOP(=O)(O)CP(=O)(O)OC
InChIInChI=1S/C3H10O6P2/c1-8-10(4,5)3-11(6,7)9-2/h3H2,1-2H3,(H,4,5)(H,6,7)
InChIKeyWXOYSNRVHAQVSW-UHFFFAOYSA-N
MW204.05 g/mol
LogP0.61
Rot. Bonds4

About [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid

[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid (PubChem CID 20756088) has the molecular formula C3H10O6P2 and a molecular weight of 204.05 g/mol. Its IUPAC name is [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid.

Molecular Properties

Compound Name[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid
PubChem CID20756088
Molecular FormulaC3H10O6P2
Molecular Weight204.05 g/mol
Exact Mass204.00
IUPAC Name[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid
SMILESCOP(=O)(O)CP(=O)(O)OC
InChIInChI=1S/C3H10O6P2/c1-8-10(4,5)3-11(6,7)9-2/h3H2,1-2H3,(H,4,5)(H,6,7)
InChIKeyWXOYSNRVHAQVSW-UHFFFAOYSA-N
XLogP0.61
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.05
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid?
The IUPAC name of [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid (CID 20756088) is [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid.
What is the SMILES notation for [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid?
The canonical SMILES for [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid is COP(=O)(O)CP(=O)(O)OC.
What is the InChIKey of [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid?
The InChIKey is WXOYSNRVHAQVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10O6P2/c1-8-10(4,5)3-11(6,7)9-2/h3H2,1-2H3,(H,4,5)(H,6,7).
What are the key properties of [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid?
[hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid has a molecular weight of 204.05 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [hydroxy(methoxy)phosphoryl]methyl-methoxyphosphinic acid is sourced from PubChem (CID 20756088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).