10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one

C22H16O3 — CID 25233409

IUPAC10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one
SMILESO=C1c2ccccc2C(C(O)C(=O)c2ccccc2)c2ccccc21
InChIInChI=1S/C22H16O3/c23-20(14-8-2-1-3-9-14)22(25)19-15-10-4-6-12-17(15)21(24)18-13-7-5-11-16(18)19/h1-13,19,22,25H
InChIKeyUOHKCPKERRYKBE-UHFFFAOYSA-N
MW328.37 g/mol
LogP3.61
Rot. Bonds3

About 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one

10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one (PubChem CID 25233409) has the molecular formula C22H16O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one.

Molecular Properties

Compound Name10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one
PubChem CID25233409
Molecular FormulaC22H16O3
Molecular Weight328.37 g/mol
Exact Mass328.11
IUPAC Name10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one
SMILESO=C1c2ccccc2C(C(O)C(=O)c2ccccc2)c2ccccc21
InChIInChI=1S/C22H16O3/c23-20(14-8-2-1-3-9-14)22(25)19-15-10-4-6-12-17(15)21(24)18-13-7-5-11-16(18)19/h1-13,19,22,25H
InChIKeyUOHKCPKERRYKBE-UHFFFAOYSA-N
XLogP3.61
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-diphenylethane-1,2-dione;phenanthrene-9,10-dione
CID 175371588
anthracene-9,10-dione;carbamic acid
CID 70556478
anthracene-9,10-dione;carbonochloridic acid
CID 88712965
2-methyl-4-(2-oxo-1,2-diphenylethyl)-4H-isoquinoline-1,3-dione
CID 11360676
10-[(1S)-3-oxo-1-phenylpentyl]-10H-anthracen-9-one
CID 46862210
10-[(1S)-1-(2-methoxyphenyl)-3-oxobutyl]-10H-anthracen-9-one
CID 46862106
2,3-dibenzoyl-1,4-diphenylbutane-1,4-dione
CID 4277936
2-(3-oxo-1H-2-benzofuran-1-yl)-1-phenylbutane-1,3-dione
CID 10756184
(3S)-3-(9H-fluoren-9-yl)-1,3-diphenylpropan-1-one
CID 139084691
anthracene-9,10-dione;phthalic acid
CID 158904853
lithium;anthracene-9,10-dione;hydride
CID 174683199
CID 67824005
CID 67824005

Frequently Asked Questions

What is the IUPAC name of 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one?
The IUPAC name of 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one (CID 25233409) is 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one.
What is the SMILES notation for 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one?
The canonical SMILES for 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one is O=C1c2ccccc2C(C(O)C(=O)c2ccccc2)c2ccccc21.
What is the InChIKey of 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one?
The InChIKey is UOHKCPKERRYKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16O3/c23-20(14-8-2-1-3-9-14)22(25)19-15-10-4-6-12-17(15)21(24)18-13-7-5-11-16(18)19/h1-13,19,22,25H.
What are the key properties of 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one?
10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one has a molecular weight of 328.37 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(1-hydroxy-2-oxo-2-phenylethyl)-10H-anthracen-9-one is sourced from PubChem (CID 25233409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).