[aminooxymethyl(hydroxymethyl)phosphanyl]methanol

C3H10NO3P — CID 122677970

IUPAC[aminooxymethyl(hydroxymethyl)phosphanyl]methanol
SMILESNOCP(CO)CO
InChIInChI=1S/C3H10NO3P/c4-7-3-8(1-5)2-6/h5-6H,1-4H2
InChIKeyMEZPRALUEMMMQI-UHFFFAOYSA-N
MW139.09 g/mol
LogP-0.78
Rot. Bonds4

About [aminooxymethyl(hydroxymethyl)phosphanyl]methanol

[aminooxymethyl(hydroxymethyl)phosphanyl]methanol (PubChem CID 122677970) has the molecular formula C3H10NO3P and a molecular weight of 139.09 g/mol. Its IUPAC name is [aminooxymethyl(hydroxymethyl)phosphanyl]methanol.

Molecular Properties

Compound Name[aminooxymethyl(hydroxymethyl)phosphanyl]methanol
PubChem CID122677970
Molecular FormulaC3H10NO3P
Molecular Weight139.09 g/mol
Exact Mass139.04
IUPAC Name[aminooxymethyl(hydroxymethyl)phosphanyl]methanol
SMILESNOCP(CO)CO
InChIInChI=1S/C3H10NO3P/c4-7-3-8(1-5)2-6/h5-6H,1-4H2
InChIKeyMEZPRALUEMMMQI-UHFFFAOYSA-N
XLogP-0.78
TPSA75.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.09
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [aminooxymethyl(hydroxymethyl)phosphanyl]methanol?
The IUPAC name of [aminooxymethyl(hydroxymethyl)phosphanyl]methanol (CID 122677970) is [aminooxymethyl(hydroxymethyl)phosphanyl]methanol.
What is the SMILES notation for [aminooxymethyl(hydroxymethyl)phosphanyl]methanol?
The canonical SMILES for [aminooxymethyl(hydroxymethyl)phosphanyl]methanol is NOCP(CO)CO.
What is the InChIKey of [aminooxymethyl(hydroxymethyl)phosphanyl]methanol?
The InChIKey is MEZPRALUEMMMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10NO3P/c4-7-3-8(1-5)2-6/h5-6H,1-4H2.
What are the key properties of [aminooxymethyl(hydroxymethyl)phosphanyl]methanol?
[aminooxymethyl(hydroxymethyl)phosphanyl]methanol has a molecular weight of 139.09 g/mol, XLogP of -0.78, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [aminooxymethyl(hydroxymethyl)phosphanyl]methanol is sourced from PubChem (CID 122677970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).