(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one

C15H12O3 — CID 70979390

IUPAC(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one
SMILESO=C1Cc2ccc(O)cc2O[C@H]1c1ccccc1
InChIInChI=1S/C15H12O3/c16-12-7-6-11-8-13(17)15(18-14(11)9-12)10-4-2-1-3-5-10/h1-7,9,15-16H,8H2/t15-/m0/s1
InChIKeyVHGNNAPEISCEER-HNNXBMFYSA-N
MW240.26 g/mol
LogP2.64
Rot. Bonds1

About (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one

(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one (PubChem CID 70979390) has the molecular formula C15H12O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one.

Molecular Properties

Compound Name(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one
PubChem CID70979390
Molecular FormulaC15H12O3
Molecular Weight240.26 g/mol
Exact Mass240.08
IUPAC Name(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one
SMILESO=C1Cc2ccc(O)cc2O[C@H]1c1ccccc1
InChIInChI=1S/C15H12O3/c16-12-7-6-11-8-13(17)15(18-14(11)9-12)10-4-2-1-3-5-10/h1-7,9,15-16H,8H2/t15-/m0/s1
InChIKeyVHGNNAPEISCEER-HNNXBMFYSA-N
XLogP2.64
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one?
The IUPAC name of (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one (CID 70979390) is (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one.
What is the SMILES notation for (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one?
The canonical SMILES for (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one is O=C1Cc2ccc(O)cc2O[C@H]1c1ccccc1.
What is the InChIKey of (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one?
The InChIKey is VHGNNAPEISCEER-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H12O3/c16-12-7-6-11-8-13(17)15(18-14(11)9-12)10-4-2-1-3-5-10/h1-7,9,15-16H,8H2/t15-/m0/s1.
What are the key properties of (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one?
(2S)-7-hydroxy-2-phenyl-4H-chromen-3-one has a molecular weight of 240.26 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-7-hydroxy-2-phenyl-4H-chromen-3-one is sourced from PubChem (CID 70979390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).