trihydroxy(phenoxy)phosphanium

C6H8O4P+ — CID 11592959

IUPACtrihydroxy(phenoxy)phosphanium
SMILESO[P+](O)(O)Oc1ccccc1
InChIInChI=1S/C6H8O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,7-9H/q+1
InChIKeyUTWWSYACTAORJM-UHFFFAOYSA-N
MW175.10 g/mol
LogP0.72
Rot. Bonds2

About trihydroxy(phenoxy)phosphanium

trihydroxy(phenoxy)phosphanium (PubChem CID 11592959) has the molecular formula C6H8O4P+ and a molecular weight of 175.10 g/mol. Its IUPAC name is trihydroxy(phenoxy)phosphanium.

Molecular Properties

Compound Nametrihydroxy(phenoxy)phosphanium
PubChem CID11592959
Molecular FormulaC6H8O4P+
Molecular Weight175.10 g/mol
Exact Mass175.02
IUPAC Nametrihydroxy(phenoxy)phosphanium
SMILESO[P+](O)(O)Oc1ccccc1
InChIInChI=1S/C6H8O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,7-9H/q+1
InChIKeyUTWWSYACTAORJM-UHFFFAOYSA-N
XLogP0.72
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.10
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dichloro-hydroxy-phenoxyphosphanium
CID 23414991
methoxy(triphenoxy)phosphanium
CID 175056731
1-phenoxyethanol
CID 66611531
dimethyl(diphenoxy)phosphanium
CID 118068912
1-phenoxyethanol;trihydrate
CID 175915128
hydroxy-phenoxy-dipropylphosphanium
CID 69049666
1-phenoxypropane-1,2-diol
CID 22140567
cyclohexa-2,5-diene-1,4-dione;hydroxy-diphenoxy-phenylphosphanium
CID 175409528
chloroform;1-phenoxyethanol
CID 160851082
anisole;1-phenoxyethanol
CID 143208941
hydroxymethoxy(phenoxy)methanol
CID 143884409
1-phenoxy-2-phenylethanol
CID 54118978

Frequently Asked Questions

What is the IUPAC name of trihydroxy(phenoxy)phosphanium?
The IUPAC name of trihydroxy(phenoxy)phosphanium (CID 11592959) is trihydroxy(phenoxy)phosphanium.
What is the SMILES notation for trihydroxy(phenoxy)phosphanium?
The canonical SMILES for trihydroxy(phenoxy)phosphanium is O[P+](O)(O)Oc1ccccc1.
What is the InChIKey of trihydroxy(phenoxy)phosphanium?
The InChIKey is UTWWSYACTAORJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,7-9H/q+1.
What are the key properties of trihydroxy(phenoxy)phosphanium?
trihydroxy(phenoxy)phosphanium has a molecular weight of 175.10 g/mol, XLogP of 0.72, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(phenoxy)phosphanium is sourced from PubChem (CID 11592959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).