sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium

C7H8NaO3P+2 — CID 54606769

IUPACsodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium
SMILESO=[P+](O)C(O)c1ccccc1.[Na+]
InChIInChI=1S/C7H7O3P.Na/c8-7(11(9)10)6-4-2-1-3-5-6;/h1-5,7-8H;/q;+1/p+1
InChIKeyUKNAYQWNMMGCNX-UHFFFAOYSA-O
MW194.10 g/mol
LogP-1.58
Rot. Bonds2

About sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium

sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium (PubChem CID 54606769) has the molecular formula C7H8NaO3P+2 and a molecular weight of 194.10 g/mol. Its IUPAC name is sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium.

Molecular Properties

Compound Namesodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium
PubChem CID54606769
Molecular FormulaC7H8NaO3P+2
Molecular Weight194.10 g/mol
Exact Mass194.01
IUPAC Namesodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium
SMILESO=[P+](O)C(O)c1ccccc1.[Na+]
InChIInChI=1S/C7H7O3P.Na/c8-7(11(9)10)6-4-2-1-3-5-6;/h1-5,7-8H;/q;+1/p+1
InChIKeyUKNAYQWNMMGCNX-UHFFFAOYSA-O
XLogP-1.58
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.10
LogP ≤ 5-1.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium
CID 90333087
hexasodium;hydride;hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium;hydrate
CID 173341084
1,3-dihydroxypropan-2-one;hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium
CID 70579978
benzhydryloxy-hydroxy-oxophosphanium
CID 66793238
hydroxy-[[hydroxy(oxo)silyl]oxy-phenylmethyl]-oxophosphanium
CID 70398699
1,2-diphenylethane-1,2-diol
CID 159073808
hydroxy-oxo-[(R)-phenyl-[[(R)-phenyl(phospho)methyl]amino]methyl]phosphanium
CID 139247816
1-[4-(1,2-dihydroxy-2-phenylethyl)phenyl]-2-phenylethane-1,2-diol
CID 14066931
(2R)-2-hydroxy-2-phenylacetic acid
CID 139040954
2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-2-hydroxyacetic acid
CID 11019130
dihydroxy(oxo)phosphanium;1-phenylundecan-1-ol
CID 69241764
1,3-diphenylpropan-2-yl-hydroxy-oxophosphanium
CID 151391700

Frequently Asked Questions

What is the IUPAC name of sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium?
The IUPAC name of sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium (CID 54606769) is sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium.
What is the SMILES notation for sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium?
The canonical SMILES for sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium is O=[P+](O)C(O)c1ccccc1.[Na+].
What is the InChIKey of sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium?
The InChIKey is UKNAYQWNMMGCNX-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H7O3P.Na/c8-7(11(9)10)6-4-2-1-3-5-6;/h1-5,7-8H;/q;+1/p+1.
What are the key properties of sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium?
sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium has a molecular weight of 194.10 g/mol, XLogP of -1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium hydroxy-[hydroxy(phenyl)methyl]-oxophosphanium is sourced from PubChem (CID 54606769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).