cerium;1-(2-hydroxyphenyl)ethanone

C8H8CeO2 — CID 174280590

IUPACcerium;1-(2-hydroxyphenyl)ethanone
SMILESCC(=O)c1ccccc1O.[Ce]
InChIInChI=1S/C8H8O2.Ce/c1-6(9)7-4-2-3-5-8(7)10;/h2-5,10H,1H3;
InChIKeyCVXSOWWMKYPXJV-UHFFFAOYSA-N
MW276.27 g/mol
LogP1.59
Rot. Bonds1

About cerium;1-(2-hydroxyphenyl)ethanone

cerium;1-(2-hydroxyphenyl)ethanone (PubChem CID 174280590) has the molecular formula C8H8CeO2 and a molecular weight of 276.27 g/mol. Its IUPAC name is cerium;1-(2-hydroxyphenyl)ethanone.

Molecular Properties

Compound Namecerium;1-(2-hydroxyphenyl)ethanone
PubChem CID174280590
Molecular FormulaC8H8CeO2
Molecular Weight276.27 g/mol
Exact Mass275.96
IUPAC Namecerium;1-(2-hydroxyphenyl)ethanone
SMILESCC(=O)c1ccccc1O.[Ce]
InChIInChI=1S/C8H8O2.Ce/c1-6(9)7-4-2-3-5-8(7)10;/h2-5,10H,1H3;
InChIKeyCVXSOWWMKYPXJV-UHFFFAOYSA-N
XLogP1.59
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(1-(2-hydroxyphenyl)ethanone);zirconium
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CID 102513692
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3-(2-hydroxyphenyl)but-3-en-2-one
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CID 158730287
ethane;1-(2-methylphenyl)ethanone
CID 91374073
1-(2-chlorophenyl)ethanone;hydrochloride
CID 174743581
sodium;2-hydroxybenzoic acid;acetate
CID 174935764
1-(2-hydroxyphenyl)-3-methylbut-2-en-1-one
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Frequently Asked Questions

What is the IUPAC name of cerium;1-(2-hydroxyphenyl)ethanone?
The IUPAC name of cerium;1-(2-hydroxyphenyl)ethanone (CID 174280590) is cerium;1-(2-hydroxyphenyl)ethanone.
What is the SMILES notation for cerium;1-(2-hydroxyphenyl)ethanone?
The canonical SMILES for cerium;1-(2-hydroxyphenyl)ethanone is CC(=O)c1ccccc1O.[Ce].
What is the InChIKey of cerium;1-(2-hydroxyphenyl)ethanone?
The InChIKey is CVXSOWWMKYPXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2.Ce/c1-6(9)7-4-2-3-5-8(7)10;/h2-5,10H,1H3;.
What are the key properties of cerium;1-(2-hydroxyphenyl)ethanone?
cerium;1-(2-hydroxyphenyl)ethanone has a molecular weight of 276.27 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;1-(2-hydroxyphenyl)ethanone is sourced from PubChem (CID 174280590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).