[2-(2-hydroxyphenyl)phenyl] benzoate

C19H14O3 — CID 14400054

IUPAC[2-(2-hydroxyphenyl)phenyl] benzoate
SMILESO=C(Oc1ccccc1-c1ccccc1O)c1ccccc1
InChIInChI=1S/C19H14O3/c20-17-12-6-4-10-15(17)16-11-5-7-13-18(16)22-19(21)14-8-2-1-3-9-14/h1-13,20H
InChIKeySZGDPFDHVDKVOC-UHFFFAOYSA-N
MW290.32 g/mol
LogP4.28
Rot. Bonds3

About [2-(2-hydroxyphenyl)phenyl] benzoate

[2-(2-hydroxyphenyl)phenyl] benzoate (PubChem CID 14400054) has the molecular formula C19H14O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is [2-(2-hydroxyphenyl)phenyl] benzoate.

Molecular Properties

Compound Name[2-(2-hydroxyphenyl)phenyl] benzoate
PubChem CID14400054
Molecular FormulaC19H14O3
Molecular Weight290.32 g/mol
Exact Mass290.09
IUPAC Name[2-(2-hydroxyphenyl)phenyl] benzoate
SMILESO=C(Oc1ccccc1-c1ccccc1O)c1ccccc1
InChIInChI=1S/C19H14O3/c20-17-12-6-4-10-15(17)16-11-5-7-13-18(16)22-19(21)14-8-2-1-3-9-14/h1-13,20H
InChIKeySZGDPFDHVDKVOC-UHFFFAOYSA-N
XLogP4.28
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(2-hydroxyphenyl)phenyl] benzoate?
The IUPAC name of [2-(2-hydroxyphenyl)phenyl] benzoate (CID 14400054) is [2-(2-hydroxyphenyl)phenyl] benzoate.
What is the SMILES notation for [2-(2-hydroxyphenyl)phenyl] benzoate?
The canonical SMILES for [2-(2-hydroxyphenyl)phenyl] benzoate is O=C(Oc1ccccc1-c1ccccc1O)c1ccccc1.
What is the InChIKey of [2-(2-hydroxyphenyl)phenyl] benzoate?
The InChIKey is SZGDPFDHVDKVOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O3/c20-17-12-6-4-10-15(17)16-11-5-7-13-18(16)22-19(21)14-8-2-1-3-9-14/h1-13,20H.
What are the key properties of [2-(2-hydroxyphenyl)phenyl] benzoate?
[2-(2-hydroxyphenyl)phenyl] benzoate has a molecular weight of 290.32 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-hydroxyphenyl)phenyl] benzoate is sourced from PubChem (CID 14400054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).