7-hydroxy-2-(2-phenylethyl)chromen-4-one

C17H14O3 — CID 10890802

IUPAC7-hydroxy-2-(2-phenylethyl)chromen-4-one
SMILESO=c1cc(CCc2ccccc2)oc2cc(O)ccc12
InChIInChI=1S/C17H14O3/c18-13-7-9-15-16(19)11-14(20-17(15)10-13)8-6-12-4-2-1-3-5-12/h1-5,7,9-11,18H,6,8H2
InChIKeyQVPPGYBSJQCGTN-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.28
Rot. Bonds3

About 7-hydroxy-2-(2-phenylethyl)chromen-4-one

7-hydroxy-2-(2-phenylethyl)chromen-4-one (PubChem CID 10890802) has the molecular formula C17H14O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 7-hydroxy-2-(2-phenylethyl)chromen-4-one.

Molecular Properties

Compound Name7-hydroxy-2-(2-phenylethyl)chromen-4-one
PubChem CID10890802
Molecular FormulaC17H14O3
Molecular Weight266.30 g/mol
Exact Mass266.09
IUPAC Name7-hydroxy-2-(2-phenylethyl)chromen-4-one
SMILESO=c1cc(CCc2ccccc2)oc2cc(O)ccc12
InChIInChI=1S/C17H14O3/c18-13-7-9-15-16(19)11-14(20-17(15)10-13)8-6-12-4-2-1-3-5-12/h1-5,7,9-11,18H,6,8H2
InChIKeyQVPPGYBSJQCGTN-UHFFFAOYSA-N
XLogP3.28
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]chromen-4-one
CID 10493135
7-hydroxy-2-[(4-hydroxyphenyl)methyl]chromen-4-one
CID 10084377
7-hydroxy-2-(1-hydroxy-2-phenylethyl)chromen-4-one
CID 123634967
7-hydroxy-2-phenylchromen-4-one
CID 5281894
5-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]chromen-4-one
CID 118278480
3-benzyl-4,7-dihydroxychromen-2-one
CID 54682330
4-hydroxy-6-(2-phenylethyl)-3-(2-phenylethylsulfanyl)pyran-2-one
CID 70071089
3-benzyl-7-hydroxy-2-methylchromen-4-one
CID 86159483
7-hydroxy-2-[(4-methoxyphenyl)methyl]chromen-4-one
CID 10708015
2-[2-(3-hydroxy-4-methoxyphenyl)ethyl]chromen-4-one
CID 162852587
7-hydroxy-2-(2-phenylethyl)-6-[[(6S,7R)-6,7,8-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-5-yl]oxy]chromen-4-one
CID 5320527
6-hydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)ethyl]chromen-4-one
CID 162857287

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-2-(2-phenylethyl)chromen-4-one?
The IUPAC name of 7-hydroxy-2-(2-phenylethyl)chromen-4-one (CID 10890802) is 7-hydroxy-2-(2-phenylethyl)chromen-4-one.
What is the SMILES notation for 7-hydroxy-2-(2-phenylethyl)chromen-4-one?
The canonical SMILES for 7-hydroxy-2-(2-phenylethyl)chromen-4-one is O=c1cc(CCc2ccccc2)oc2cc(O)ccc12.
What is the InChIKey of 7-hydroxy-2-(2-phenylethyl)chromen-4-one?
The InChIKey is QVPPGYBSJQCGTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O3/c18-13-7-9-15-16(19)11-14(20-17(15)10-13)8-6-12-4-2-1-3-5-12/h1-5,7,9-11,18H,6,8H2.
What are the key properties of 7-hydroxy-2-(2-phenylethyl)chromen-4-one?
7-hydroxy-2-(2-phenylethyl)chromen-4-one has a molecular weight of 266.30 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-2-(2-phenylethyl)chromen-4-one is sourced from PubChem (CID 10890802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).