6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one

C17H16O4 — CID 24978119

IUPAC6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one
SMILESCOc1cc(OC)c2c(c1)C(=O)CC(c1ccccc1)O2
InChIInChI=1S/C17H16O4/c1-19-12-8-13-14(18)10-15(11-6-4-3-5-7-11)21-17(13)16(9-12)20-2/h3-9,15H,10H2,1-2H3
InChIKeyYDSZINANHNKXEM-UHFFFAOYSA-N
MW284.31 g/mol
LogP3.41
Rot. Bonds3

About 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one

6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one (PubChem CID 24978119) has the molecular formula C17H16O4 and a molecular weight of 284.31 g/mol. Its IUPAC name is 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one
PubChem CID24978119
Molecular FormulaC17H16O4
Molecular Weight284.31 g/mol
Exact Mass284.10
IUPAC Name6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one
SMILESCOc1cc(OC)c2c(c1)C(=O)CC(c1ccccc1)O2
InChIInChI=1S/C17H16O4/c1-19-12-8-13-14(18)10-15(11-6-4-3-5-7-11)21-17(13)16(9-12)20-2/h3-9,15H,10H2,1-2H3
InChIKeyYDSZINANHNKXEM-UHFFFAOYSA-N
XLogP3.41
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-7-methoxy-2-phenyl-2,3-dihydrochromen-4-one
CID 12073467
(2S)-5,7-dimethoxy-8-(methoxymethyl)-2-phenyl-2,3-dihydrochromen-4-one
CID 162807777
(3R,5R,13R)-9-methoxy-4,4-dimethyl-13-phenyl-6,14-dioxatetracyclo[8.4.0.02,7.03,5]tetradeca-1,7,9-trien-11-one
CID 98050771
2-(3,4-dimethoxyphenyl)-6-methoxy-2,3-dihydrochromen-4-one
CID 2922801
(2S)-8-[5-[(2S)-5,7-dimethoxy-4-oxo-2,3-dihydrochromen-2-yl]-2-methoxyphenyl]-5,7-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one
CID 163039099
(2S)-7-methoxy-8-[(E)-3-methoxy-3-methylbut-1-enyl]-2-phenyl-2,3-dihydrochromen-4-one
CID 73349082
(2S)-8-[(Z,3R)-3-hydroxybut-1-enyl]-5,7-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one
CID 132987788
5-phenyloxolane-2,3-dione
CID 14450727
6-aminooxy-2-phenyl-2,3-dihydrochromen-4-one
CID 163678312
(2S)-2-(4-fluorophenyl)-6-methoxy-2,3-dihydrochromen-4-one
CID 853029
7-(4-methoxyphenyl)-3,9-dimethyl-6,7-dihydrofuro[3,2-g]chromen-5-one
CID 25147894
ethane;2-phenyl-2,3-dihydrochromen-4-one
CID 91018475

Frequently Asked Questions

What is the IUPAC name of 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one?
The IUPAC name of 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one (CID 24978119) is 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one?
The canonical SMILES for 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one is COc1cc(OC)c2c(c1)C(=O)CC(c1ccccc1)O2.
What is the InChIKey of 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one?
The InChIKey is YDSZINANHNKXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O4/c1-19-12-8-13-14(18)10-15(11-6-4-3-5-7-11)21-17(13)16(9-12)20-2/h3-9,15H,10H2,1-2H3.
What are the key properties of 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one?
6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one has a molecular weight of 284.31 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethoxy-2-phenyl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 24978119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).