Basic information
- CAS
110326-35-7- Standard SMILES
O=Cc1ccc2c(C=O)c(O)n(-c3c(Cl)cccc3Cl)c2c1- InChIKey
VAPGXGRQEWDOLC-UHFFFAOYSA-N- Molecular formula
- C16H9Cl2NO3
- Average molar mass
- 334.1 g/mol
- Monoisotopic mass
- 332.9959485
Names & identifiers
- Preferred name
- 1-(2,6-Dichlorophenyl)-3-(hydroxymethylene)-6-formylindolin-2-one
- IUPAC
- 1-(2,6-dichlorophenyl)-2-hydroxyindole-3,6-dicarbaldehyde
Names & synonyms
BRN 5593728110326-35-71-(2,6-Dichlorophenyl)-3-(hydroxymethylene)-6-formylindolin-2-one1H-Indole-6-carboxaldehyde, 2,3-dihydro-1-(2,6-dichlorophenyl)-3-(hydroxymethylene)-2-oxo-2,3-Dihydro-1-(2,6-dichlorophenyl)-3-(hydroxymethylene)-2-oxo-1H-indole-6-carboxaldehyde
Database identifiers
- CAS
110326-35-7- PubChem CID
- 60419
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 426
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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