Basic information
- Standard SMILES
COC(=O)C1(C)Cc2cc(Cl)ccc2C1=O- InChIKey
MWXOUFHHULVZCY-UHFFFAOYSA-N- Molecular formula
- C12H11ClO3
- Average molar mass
- 238.66 g/mol
Names & identifiers
- Preferred name
- methyl 5-chloro-2,3-dihydro-2-mehtyl-1-oxo-1H-indene-2-carboxylate
- IUPAC
- methyl 6-chloro-2-methyl-3-oxo-1H-indene-2-carboxylate
Names & synonyms
SCHEMBL9141221MWXOUFHHULVZCY-UHFFFAOYSA-Nmethyl 5-chloro-2,3-dihydro-2-mehtyl-1-oxo-1H-indene-2-carboxylatemethyl 5-chloro-2,3-dihydro-2-methyl-1-oxo-1H-indene-2-carboxylatemethyl-5-chloro-2,3-dihydro-2-methyl-1-oxo-1H-indene-2-carboxylate
Database identifiers
- PubChem CID
- 19384693
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 328
Related reactions
4 records
Compound notes
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