Basic information
- CAS
64788-59-6- Standard SMILES
CCCCCn1c(Cl)c(C=O)c2ccccc21- InChIKey
BHGSBMXRFUUHNT-UHFFFAOYSA-N- Molecular formula
- C14H16ClNO
- Average molar mass
- 249.73 g/mol
- Monoisotopic mass
- 249.0920418
Names & identifiers
- Preferred name
- 2-Chloro-1-pentyl-1H-indole-3-carbaldehyde
- IUPAC
- 2-chloro-1-pentylindole-3-carbaldehyde
Names & synonyms
64788-59-6NSC2683062-Chloro-1-pentyl-1H-indole-3-carbaldehydeSCHEMBL2362870DTXSID70313250NSC-268306
Database identifiers
- CAS
64788-59-6- PubChem CID
- 320441
- DTXSID
DTXSID70313250
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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