2-[(4-Hydroxy-3,5-dimethylphenyl)methylidene]-1H-indene-1,3(2H)-dione
Basic information
- CAS
53566-05-5- Standard SMILES
Cc1cc(C=C2C(=O)c3ccccc3C2=O)cc(C)c1O- InChIKey
MGCKWRPIJYUSJD-UHFFFAOYSA-N- Molecular formula
- C18H14O3
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.0942943
Names & identifiers
- Preferred name
- 2-[(4-Hydroxy-3,5-dimethylphenyl)methylidene]-1H-indene-1,3(2H)-dione
- IUPAC
- 2-[(4-hydroxy-3,5-dimethylphenyl)methylidene]indene-1,3-dione
Names & synonyms
53566-05-5NSC281760DTXSID303142632-[(4-Hydroxy-3,5-dimethylphenyl)methylidene]-1H-indene-1,3(2H)-dioneAKOS008659870NSC-281760DS-0127072-[(4-hydroxy-3,5-dimethyl-phenyl)methylidene]indene-1,3-dione
Database identifiers
- CAS
53566-05-5- PubChem CID
- 323038
- DTXSID
DTXSID30314263
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 441
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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