2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone

C17H18O2 — CID 23513084

IUPAC2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
SMILESCC(C)c1ccc(C(O)C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H18O2/c1-12(2)13-8-10-15(11-9-13)17(19)16(18)14-6-4-3-5-7-14/h3-12,17,19H,1-2H3
InChIKeyADBJVRBJNQYLNV-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.73
Rot. Bonds4

About 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone

2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone (PubChem CID 23513084) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone.

Molecular Properties

Compound Name2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
PubChem CID23513084
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
SMILESCC(C)c1ccc(C(O)C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H18O2/c1-12(2)13-8-10-15(11-9-13)17(19)16(18)14-6-4-3-5-7-14/h3-12,17,19H,1-2H3
InChIKeyADBJVRBJNQYLNV-UHFFFAOYSA-N
XLogP3.73
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-1,2-diphenylethanone
CID 159399559
formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
CID 174440021
deuterium monohydride;2-hydroxy-1,2-diphenylethanone
CID 158356694
2-hydroxy-1,2-diphenylethanone;propanoic acid
CID 159329247
2-hydroxy-1,2-diphenylethanone;prop-2-enoic acid
CID 57368066
2-hydroxy-1,2-diphenylethanone;silyloxysilane
CID 173133276
acetaldehyde;2-hydroxy-1,2-diphenylethanone;(2S)-2-hydroxy-1,2-diphenylethanone;(2R)-2-hydroxy-1-phenylpropan-1-one;methane
CID 159381131
2-hydroxy-1,2-diphenylethanone;1-phenylpropan-1-one
CID 174848942
1-phenyl-2-(4-propan-2-ylphenoxy)propan-1-one
CID 43411936
2-[4-(2-bromoethyl)phenyl]-2-hydroxy-1-phenylethanone
CID 86260257
2-hydroxy-2-(4-methoxy-3-methylphenyl)-1-phenylethanone
CID 129094734
[2-oxo-2-phenyl-1-(4-propan-2-ylbenzoyl)oxyethyl] 4-propan-2-ylbenzoate
CID 175385825

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone?
The IUPAC name of 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone (CID 23513084) is 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone.
What is the SMILES notation for 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone?
The canonical SMILES for 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone is CC(C)c1ccc(C(O)C(=O)c2ccccc2)cc1.
What is the InChIKey of 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone?
The InChIKey is ADBJVRBJNQYLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-12(2)13-8-10-15(11-9-13)17(19)16(18)14-6-4-3-5-7-14/h3-12,17,19H,1-2H3.
What are the key properties of 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone?
2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone has a molecular weight of 254.33 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone is sourced from PubChem (CID 23513084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).