sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium

C3H8NNaO3P+ — CID 173083172

IUPACsodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium
SMILESCO[P+](=O)C(C)=NO.[H-].[Na+]
InChIInChI=1S/C3H6NO3P.Na.H/c1-3(4-5)8(6)7-2;;/h1-2H3;;/q;+1;-1/p+1
InChIKeyUCABCHHWJPUQPV-UHFFFAOYSA-O
MW160.06 g/mol
LogP-1.70
Rot. Bonds2

About sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium

sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium (PubChem CID 173083172) has the molecular formula C3H8NNaO3P+ and a molecular weight of 160.06 g/mol. Its IUPAC name is sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium.

Molecular Properties

Compound Namesodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium
PubChem CID173083172
Molecular FormulaC3H8NNaO3P+
Molecular Weight160.06 g/mol
Exact Mass160.01
IUPAC Namesodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium
SMILESCO[P+](=O)C(C)=NO.[H-].[Na+]
InChIInChI=1S/C3H6NO3P.Na.H/c1-3(4-5)8(6)7-2;;/h1-2H3;;/q;+1;-1/p+1
InChIKeyUCABCHHWJPUQPV-UHFFFAOYSA-O
XLogP-1.70
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.06
LogP ≤ 5-1.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'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 sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium?
The IUPAC name of sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium (CID 173083172) is sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium.
What is the SMILES notation for sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium?
The canonical SMILES for sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium is CO[P+](=O)C(C)=NO.[H-].[Na+].
What is the InChIKey of sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium?
The InChIKey is UCABCHHWJPUQPV-UHFFFAOYSA-O. The full InChI is InChI=1S/C3H6NO3P.Na.H/c1-3(4-5)8(6)7-2;;/h1-2H3;;/q;+1;-1/p+1.
What are the key properties of sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium?
sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium has a molecular weight of 160.06 g/mol, XLogP of -1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;(N-hydroxy-C-methylcarbonimidoyl)-methoxy-oxophosphanium is sourced from PubChem (CID 173083172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).