7-methoxy-2-phenyl-2,3-dihydrochromen-4-one

C16H14O3 — CID 2825024

IUPAC7-methoxy-2-phenyl-2,3-dihydrochromen-4-one
SMILESCOc1ccc2c(c1)OC(c1ccccc1)CC2=O
InChIInChI=1S/C16H14O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-9,15H,10H2,1H3
InChIKeyVYESEQLQFXUROZ-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.40
Rot. Bonds2

About 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one

7-methoxy-2-phenyl-2,3-dihydrochromen-4-one (PubChem CID 2825024) has the molecular formula C16H14O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name7-methoxy-2-phenyl-2,3-dihydrochromen-4-one
PubChem CID2825024
Molecular FormulaC16H14O3
Molecular Weight254.29 g/mol
Exact Mass254.09
IUPAC Name7-methoxy-2-phenyl-2,3-dihydrochromen-4-one
SMILESCOc1ccc2c(c1)OC(c1ccccc1)CC2=O
InChIInChI=1S/C16H14O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-9,15H,10H2,1H3
InChIKeyVYESEQLQFXUROZ-UHFFFAOYSA-N
XLogP3.40
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one?
The IUPAC name of 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one (CID 2825024) is 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one?
The canonical SMILES for 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one is COc1ccc2c(c1)OC(c1ccccc1)CC2=O.
What is the InChIKey of 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one?
The InChIKey is VYESEQLQFXUROZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-9,15H,10H2,1H3.
What are the key properties of 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one?
7-methoxy-2-phenyl-2,3-dihydrochromen-4-one has a molecular weight of 254.29 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-phenyl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 2825024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).