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Basic information
- Standard SMILES
COc1c(C=O)ccc2c1CCC2- InChIKey
PZCBSIUMTPTLPI-UHFFFAOYSA-N- Molecular formula
- C11H12O2
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.08372962
Names & identifiers
- Preferred name
- 4-Methoxy-indan-5-carbaldehyde
- IUPAC
- 4-methoxy-2,3-dihydro-1H-indene-5-carbaldehyde
Names & synonyms
4-Methoxy-indan-5-carbaldehyde1092553-20-2SCHEMBL837149PZCBSIUMTPTLPI-UHFFFAOYSA-NDB-349482
Database identifiers
- PubChem CID
- 86643104
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 191
Related reactions
6 records
Compound notes
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