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3,3,4-Triphenylbutan-2-one

HCID 219153
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Basic information

CAS
5350-79-8
Standard SMILES
CC(=O)C(Cc1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
GYDDACBLWFSXOM-UHFFFAOYSA-N
Molecular formula
C22H20O
Average molar mass
300.4 g/mol
Monoisotopic mass
300.15141526

Names & identifiers

Preferred name
3,3,4-Triphenylbutan-2-one
IUPAC
3,3,4-triphenylbutan-2-one

Names & synonyms

3,3,4-triphenylbutan-2-one5350-79-8DTXSID20276947RefChem:270096DTXCID60228107NSC663,4-TRIPHENYL-2-BUTANONEDS-004617

Database identifiers

CAS
5350-79-8
PubChem CID
219153
DTXSID
DTXSID20276947
Nikkaji
J2.860.890J

Properties

Computed structural properties

XLogP
5
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
23
Formal charge
0
Complexity
349

Related reactions

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Compound notes

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