hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane

CH8NO6P2+ — CID 88668138

IUPAChydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane
SMILESC.O=[P+](O)OP(=O)(O)NO
InChIInChI=1S/CH4.H3NO6P2/c;2-1-9(5,6)7-8(3)4/h1H4;(H3-,1,2,3,4,5,6)/p+1
InChIKeyRMRCZTCDBSVUGH-UHFFFAOYSA-O
MW192.02 g/mol
LogP0.37
Rot. Bonds3

About hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane

hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane (PubChem CID 88668138) has the molecular formula CH8NO6P2+ and a molecular weight of 192.02 g/mol. Its IUPAC name is hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane.

Molecular Properties

Compound Namehydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane
PubChem CID88668138
Molecular FormulaCH8NO6P2+
Molecular Weight192.02 g/mol
Exact Mass191.98
IUPAC Namehydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane
SMILESC.O=[P+](O)OP(=O)(O)NO
InChIInChI=1S/CH4.H3NO6P2/c;2-1-9(5,6)7-8(3)4/h1H4;(H3-,1,2,3,4,5,6)/p+1
InChIKeyRMRCZTCDBSVUGH-UHFFFAOYSA-O
XLogP0.37
TPSA116.09 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.02
LogP ≤ 50.37
H-Bond Donors ≤ 54
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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Related Compounds

dihydroxy(oxo)phosphanium;hydroxy-[hydroxy-[hydroxy(oxo)phosphaniumyl]oxyphosphoryl]oxy-oxophosphanium
CID 175979606
tripotassium;hydride;hydron;hydroxy-oxo-phosphonooxyphosphanium
CID 174963858
[amino-[hydroxy(oxo)phosphaniumyl]oxyphosphoryl]oxy-hydroxy-oxophosphanium
CID 174491509
hydroxy-[hydroxy-[hydroxy(methyl)phosphoryl]oxyphosphoryl]oxy-oxophosphanium
CID 118019435
hydroxy-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxy-oxophosphanium
CID 173366635
[cyclopropyl(hydroxy)phosphoryl]oxy-hydroxy-oxophosphanium
CID 88508087
hydroxy-[hydroxy(oxo)phosphaniumyl]oxy-oxophosphanium;phosphoric acid;zinc
CID 174802385
[ethyl(methoxy)phosphoryl]oxy-hydroxy-oxophosphanium
CID 168867703
hydroxy-[hydroxy-[hydroxy(oxo)phosphaniumyl]oxyphosphoryl]oxy-oxophosphanium;triazine
CID 159387391
dihydroxy(oxo)phosphanium;phosphoric acid;zirconium
CID 173299921
dihydroxy(oxo)phosphanium;oxophosphanium;phosphoric acid
CID 162249587
methane;phosphoric acid
CID 18515646

Frequently Asked Questions

What is the IUPAC name of hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane?
The IUPAC name of hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane (CID 88668138) is hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane.
What is the SMILES notation for hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane?
The canonical SMILES for hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane is C.O=[P+](O)OP(=O)(O)NO.
What is the InChIKey of hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane?
The InChIKey is RMRCZTCDBSVUGH-UHFFFAOYSA-O. The full InChI is InChI=1S/CH4.H3NO6P2/c;2-1-9(5,6)7-8(3)4/h1H4;(H3-,1,2,3,4,5,6)/p+1.
What are the key properties of hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane?
hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane has a molecular weight of 192.02 g/mol, XLogP of 0.37, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-[hydroxy-(hydroxyamino)phosphoryl]oxy-oxophosphanium;methane is sourced from PubChem (CID 88668138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).