Basic information
- CAS
65547-94-6- Standard SMILES
CCOC(=O)c1c(N)n(O)c2cc(OC)ccc12- InChIKey
WTAXRCOYEKHDOL-UHFFFAOYSA-N- Molecular formula
- C12H14N2O4
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.09535693
Names & identifiers
- Preferred name
- Ethyl 2-amino-1-hydroxy-6-methoxy-1H-indole-3-carboxylate
- IUPAC
- ethyl 2-amino-1-hydroxy-6-methoxyindole-3-carboxylate
Names & synonyms
65547-94-6Ethyl 2-amino-1-hydroxy-6-methoxy-1H-indole-3-carboxylateDTXSID80495197
Database identifiers
- CAS
65547-94-6- PubChem CID
- 12377572
- DTXSID
DTXSID80495197- Nikkaji
- J2.260.159H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…