oxalic acid;2-phenylphenol

C14H12O5 — CID 162319962

IUPACoxalic acid;2-phenylphenol
SMILESO=C(O)C(=O)O.Oc1ccccc1-c1ccccc1
InChIInChI=1S/C12H10O.C2H2O4/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;3-1(4)2(5)6/h1-9,13H;(H,3,4)(H,5,6)
InChIKeyKQOIFWNHWQSRQK-UHFFFAOYSA-N
MW260.25 g/mol
LogP2.21
Rot. Bonds1

About oxalic acid;2-phenylphenol

oxalic acid;2-phenylphenol (PubChem CID 162319962) has the molecular formula C14H12O5 and a molecular weight of 260.25 g/mol. Its IUPAC name is oxalic acid;2-phenylphenol.

Molecular Properties

Compound Nameoxalic acid;2-phenylphenol
PubChem CID162319962
Molecular FormulaC14H12O5
Molecular Weight260.25 g/mol
Exact Mass260.07
IUPAC Nameoxalic acid;2-phenylphenol
SMILESO=C(O)C(=O)O.Oc1ccccc1-c1ccccc1
InChIInChI=1S/C12H10O.C2H2O4/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;3-1(4)2(5)6/h1-9,13H;(H,3,4)(H,5,6)
InChIKeyKQOIFWNHWQSRQK-UHFFFAOYSA-N
XLogP2.21
TPSA94.83 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.25
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxalic acid;2-phenylphenol?
The IUPAC name of oxalic acid;2-phenylphenol (CID 162319962) is oxalic acid;2-phenylphenol.
What is the SMILES notation for oxalic acid;2-phenylphenol?
The canonical SMILES for oxalic acid;2-phenylphenol is O=C(O)C(=O)O.Oc1ccccc1-c1ccccc1.
What is the InChIKey of oxalic acid;2-phenylphenol?
The InChIKey is KQOIFWNHWQSRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O.C2H2O4/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;3-1(4)2(5)6/h1-9,13H;(H,3,4)(H,5,6).
What are the key properties of oxalic acid;2-phenylphenol?
oxalic acid;2-phenylphenol has a molecular weight of 260.25 g/mol, XLogP of 2.21, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxalic acid;2-phenylphenol is sourced from PubChem (CID 162319962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).