(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one

C15H12O3 — CID 6022229

IUPAC(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one
SMILESO=C(/C=C(\O)c1ccccc1)c1ccccc1O
InChIInChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-10,16-17H/b14-10-
InChIKeyAOJIJXJCNKMEET-UVTDQMKNSA-N
MW240.26 g/mol
LogP3.17
Rot. Bonds3

About (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one

(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one (PubChem CID 6022229) has the molecular formula C15H12O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one.

Molecular Properties

Compound Name(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one
PubChem CID6022229
Molecular FormulaC15H12O3
Molecular Weight240.26 g/mol
Exact Mass240.08
IUPAC Name(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one
SMILESO=C(/C=C(\O)c1ccccc1)c1ccccc1O
InChIInChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-10,16-17H/b14-10-
InChIKeyAOJIJXJCNKMEET-UVTDQMKNSA-N
XLogP3.17
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one?
The IUPAC name of (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one (CID 6022229) is (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one.
What is the SMILES notation for (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one?
The canonical SMILES for (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one is O=C(/C=C(\O)c1ccccc1)c1ccccc1O.
What is the InChIKey of (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one?
The InChIKey is AOJIJXJCNKMEET-UVTDQMKNSA-N. The full InChI is InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-10,16-17H/b14-10-.
What are the key properties of (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one?
(Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one has a molecular weight of 240.26 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-hydroxy-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one is sourced from PubChem (CID 6022229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).