hydroxy(oxo)phosphanium;phenylmethanol

C7H10O3P+ — CID 173314603

IUPAChydroxy(oxo)phosphanium;phenylmethanol
SMILESO=[PH+]O.OCc1ccccc1
InChIInChI=1S/C7H8O.HO2P/c8-6-7-4-2-1-3-5-7;1-3-2/h1-5,8H,6H2;3H/p+1
InChIKeyUMIARFQKYNGUTL-UHFFFAOYSA-O
MW173.13 g/mol
LogP1.10
Rot. Bonds1

About hydroxy(oxo)phosphanium;phenylmethanol

hydroxy(oxo)phosphanium;phenylmethanol (PubChem CID 173314603) has the molecular formula C7H10O3P+ and a molecular weight of 173.13 g/mol. Its IUPAC name is hydroxy(oxo)phosphanium;phenylmethanol.

Molecular Properties

Compound Namehydroxy(oxo)phosphanium;phenylmethanol
PubChem CID173314603
Molecular FormulaC7H10O3P+
Molecular Weight173.13 g/mol
Exact Mass173.04
IUPAC Namehydroxy(oxo)phosphanium;phenylmethanol
SMILESO=[PH+]O.OCc1ccccc1
InChIInChI=1S/C7H8O.HO2P/c8-6-7-4-2-1-3-5-7;1-3-2/h1-5,8H,6H2;3H/p+1
InChIKeyUMIARFQKYNGUTL-UHFFFAOYSA-O
XLogP1.10
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.13
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy(oxo)phosphanium;phenylmethanol?
The IUPAC name of hydroxy(oxo)phosphanium;phenylmethanol (CID 173314603) is hydroxy(oxo)phosphanium;phenylmethanol.
What is the SMILES notation for hydroxy(oxo)phosphanium;phenylmethanol?
The canonical SMILES for hydroxy(oxo)phosphanium;phenylmethanol is O=[PH+]O.OCc1ccccc1.
What is the InChIKey of hydroxy(oxo)phosphanium;phenylmethanol?
The InChIKey is UMIARFQKYNGUTL-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H8O.HO2P/c8-6-7-4-2-1-3-5-7;1-3-2/h1-5,8H,6H2;3H/p+1.
What are the key properties of hydroxy(oxo)phosphanium;phenylmethanol?
hydroxy(oxo)phosphanium;phenylmethanol has a molecular weight of 173.13 g/mol, XLogP of 1.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy(oxo)phosphanium;phenylmethanol is sourced from PubChem (CID 173314603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).