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4,2',4'-Trihydroxy-3,5-dimethyl-benzophenone

HCID 20458002
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(C(=O)c2ccc(O)cc2O)cc(C)c1O
InChIKey
ABFLCEXLQAODOD-UHFFFAOYSA-N
Molecular formula
C15H14O4
Average molar mass
258.27 g/mol

Names & identifiers

Preferred name
4,2',4'-Trihydroxy-3,5-dimethyl-benzophenone
IUPAC
(2,4-dihydroxyphenyl)-(4-hydroxy-3,5-dimethylphenyl)methanone

Names & synonyms

SCHEMBL11028801ABFLCEXLQAODOD-UHFFFAOYSA-N4,2',4'-trihydroxy-3,5-dimethyl-benzophenone

Database identifiers

PubChem CID
20458002

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
77.8 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
318

Related reactions

1 records
New reaction record
HRID 1262739 reaction equation
HRID 1262739As reactantuspto-grants-1984_06

Compound notes

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