hydroxy-(2-hydroxyphenyl)-oxophosphanium

C6H6O3P+ — CID 6368758

IUPAChydroxy-(2-hydroxyphenyl)-oxophosphanium
SMILESO=[P+](O)c1ccccc1O
InChIInChI=1S/C6H5O3P/c7-5-3-1-2-4-6(5)10(8)9/h1-4H,(H-,7,8,9)/p+1
InChIKeyMJCXUWWZNWJUOA-UHFFFAOYSA-O
MW157.09 g/mol
LogP0.75
Rot. Bonds1

About hydroxy-(2-hydroxyphenyl)-oxophosphanium

hydroxy-(2-hydroxyphenyl)-oxophosphanium (PubChem CID 6368758) has the molecular formula C6H6O3P+ and a molecular weight of 157.09 g/mol. Its IUPAC name is hydroxy-(2-hydroxyphenyl)-oxophosphanium.

Molecular Properties

Compound Namehydroxy-(2-hydroxyphenyl)-oxophosphanium
PubChem CID6368758
Molecular FormulaC6H6O3P+
Molecular Weight157.09 g/mol
Exact Mass157.00
IUPAC Namehydroxy-(2-hydroxyphenyl)-oxophosphanium
SMILESO=[P+](O)c1ccccc1O
InChIInChI=1S/C6H5O3P/c7-5-3-1-2-4-6(5)10(8)9/h1-4H,(H-,7,8,9)/p+1
InChIKeyMJCXUWWZNWJUOA-UHFFFAOYSA-O
XLogP0.75
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.09
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-oxo-phenylphosphanium;hydrochloride
CID 172693291
hydroxy-oxo-phenylphosphanium;zinc
CID 66795245
9H-fluoren-1-yl-hydroxy-oxophosphanium
CID 151720686
magnesium;[2-(2-carboxyethyl)phenyl]-hydroxy-oxophosphanium;hydride
CID 175003735
dimagnesium;hydroxy-oxo-phenylphosphanium;tetrachloride
CID 172736603
benzo[c][2,1]benzoxaphosphinin-6-ium 6-oxide;hydroxy-[2-(2-hydroxyphenyl)phenyl]-oxophosphanium;hydrate
CID 158608663
cyclodeca-2,4,6,8,10-pentaene-1,2-diol
CID 143742281
benzene-1,2-diol;vanadium(2+)
CID 159711752
benzene-1,2-diol;ruthenium
CID 175866633
benzene-1,2-diol;zinc
CID 70580296
benzene-1,2-diol;hydrogen peroxide
CID 22924348
bis(benzene-1,2-diol);methane
CID 158804248

Frequently Asked Questions

What is the IUPAC name of hydroxy-(2-hydroxyphenyl)-oxophosphanium?
The IUPAC name of hydroxy-(2-hydroxyphenyl)-oxophosphanium (CID 6368758) is hydroxy-(2-hydroxyphenyl)-oxophosphanium.
What is the SMILES notation for hydroxy-(2-hydroxyphenyl)-oxophosphanium?
The canonical SMILES for hydroxy-(2-hydroxyphenyl)-oxophosphanium is O=[P+](O)c1ccccc1O.
What is the InChIKey of hydroxy-(2-hydroxyphenyl)-oxophosphanium?
The InChIKey is MJCXUWWZNWJUOA-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H5O3P/c7-5-3-1-2-4-6(5)10(8)9/h1-4H,(H-,7,8,9)/p+1.
What are the key properties of hydroxy-(2-hydroxyphenyl)-oxophosphanium?
hydroxy-(2-hydroxyphenyl)-oxophosphanium has a molecular weight of 157.09 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(2-hydroxyphenyl)-oxophosphanium is sourced from PubChem (CID 6368758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).