Basic information
- Standard SMILES
COC(=O)C1Cc2ccc(C(=O)c3ccccc3)cc2C1- InChIKey
NLIJFVFTCQODAW-UHFFFAOYSA-N- Molecular formula
- C18H16O3
- Average molar mass
- 280.3 g/mol
Names & identifiers
- Preferred name
- Methyl 5-benzoyl-indan-2-carboxylate
- IUPAC
- methyl 5-benzoyl-2,3-dihydro-1H-indene-2-carboxylate
Names & synonyms
SCHEMBL11361750NLIJFVFTCQODAW-UHFFFAOYSA-NMethyl 5-benzoyl-indan-2-carboxylatemethyl 5-benzoyl-indane-2-carboxylate
Database identifiers
- PubChem CID
- 23459752
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 397
Related reactions
3 records
Compound notes
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