2-Chloro-5-methoxy-6-methyl-1H-indole-3-carbaldehyde
Basic information
- CAS
69789-86-2- Standard SMILES
COc1cc2c(C=O)c(Cl)[nH]c2cc1C- InChIKey
IKRPAWXRBBZYNZ-UHFFFAOYSA-N- Molecular formula
- C11H10ClNO2
- Average molar mass
- 223.65 g/mol
- Monoisotopic mass
- 223.0400063
Names & identifiers
- Preferred name
- 2-Chloro-5-methoxy-6-methyl-1H-indole-3-carbaldehyde
- IUPAC
- 2-chloro-5-methoxy-6-methyl-1H-indole-3-carbaldehyde
Names & synonyms
69789-86-22-chloro-5-methoxy-6-methyl-1H-indole-3-carbaldehydeDTXSID20314611RefChem:258969DTXCID60265734NSC286448NSC-286448
Database identifiers
- CAS
69789-86-2- PubChem CID
- 323739
- DTXSID
DTXSID20314611
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 42.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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