Basic information
- CAS
64802-52-4- Standard SMILES
CCOC(=O)CCCC1CNc2ccccc21- InChIKey
VUGPDYWMKXWAHF-UHFFFAOYSA-N- Molecular formula
- C14H19NO2
- Average molar mass
- 233.31 g/mol
- Monoisotopic mass
- 233.14157885
Names & identifiers
- Preferred name
- Ethyl 4-(2,3-dihydro-1H-indol-3-YL)butanoate
- IUPAC
- ethyl 4-(2,3-dihydro-1H-indol-3-yl)butanoate
Names & synonyms
64802-52-4ETHYL 4-(2,3-DIHYDRO-1H-INDOL-3-YL)BUTANOATEDTXSID10494936
Database identifiers
- CAS
64802-52-4- PubChem CID
- 12373008
- DTXSID
DTXSID10494936
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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