(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one

C15H12O4 — CID 57484831

IUPAC(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one
SMILESO=C1C[C@H](c2ccccc2O)Oc2cc(O)ccc21
InChIInChI=1S/C15H12O4/c16-9-5-6-11-13(18)8-15(19-14(11)7-9)10-3-1-2-4-12(10)17/h1-7,15-17H,8H2/t15-/m1/s1
InChIKeyNLQKFXFMWJUIHJ-OAHLLOKOSA-N
MW256.26 g/mol
LogP2.80
Rot. Bonds1

About (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one

(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one (PubChem CID 57484831) has the molecular formula C15H12O4 and a molecular weight of 256.26 g/mol. Its IUPAC name is (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one
PubChem CID57484831
Molecular FormulaC15H12O4
Molecular Weight256.26 g/mol
Exact Mass256.07
IUPAC Name(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one
SMILESO=C1C[C@H](c2ccccc2O)Oc2cc(O)ccc21
InChIInChI=1S/C15H12O4/c16-9-5-6-11-13(18)8-15(19-14(11)7-9)10-3-1-2-4-12(10)17/h1-7,15-17H,8H2/t15-/m1/s1
InChIKeyNLQKFXFMWJUIHJ-OAHLLOKOSA-N
XLogP2.80
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one?
The IUPAC name of (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one (CID 57484831) is (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one.
What is the SMILES notation for (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one?
The canonical SMILES for (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one is O=C1C[C@H](c2ccccc2O)Oc2cc(O)ccc21.
What is the InChIKey of (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one?
The InChIKey is NLQKFXFMWJUIHJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H12O4/c16-9-5-6-11-13(18)8-15(19-14(11)7-9)10-3-1-2-4-12(10)17/h1-7,15-17H,8H2/t15-/m1/s1.
What are the key properties of (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one?
(2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one has a molecular weight of 256.26 g/mol, XLogP of 2.80, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-7-hydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one is sourced from PubChem (CID 57484831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).