2-Methyl-1,5-diphenylpentane-1,3,5-trione

HCID 14303545
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Basic information

CAS
111621-81-9
Standard SMILES
CC(C(=O)CC(=O)c1ccccc1)C(=O)c1ccccc1
InChIKey
HFKJINVFBJLTCK-UHFFFAOYSA-N
Molecular formula
C18H16O3
Average molar mass
280.3 g/mol
Monoisotopic mass
280.10994437

Names & identifiers

Preferred name
2-Methyl-1,5-diphenylpentane-1,3,5-trione
IUPAC
2-methyl-1,5-diphenylpentane-1,3,5-trione

Names & synonyms

2-methyl-1,5-diphenylpentane-1,3,5-trione1,3,5-Pentanetrione, 2-methyl-1,5-diphenyl-111621-81-9DTXSID40558732RefChem:262903DTXCID90509512HFKJINVFBJLTCK-UHFFFAOYSA-NSCHEMBL93672502-methyl-1,5-diphenyl-1,3,5-pentanetrione

Database identifiers

CAS
111621-81-9
PubChem CID
14303545
DTXSID
DTXSID40558732

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
51.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
21

Related reactions

9 records
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Compound notes

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