Basic information
- CAS
100831-26-3- Standard SMILES
CN1C(=O)Cc2cc(Br)cc(Br)c21- InChIKey
RPILJMKHMRFONN-UHFFFAOYSA-N- Molecular formula
- C9H7Br2NO
- Average molar mass
- 304.97 g/mol
- Monoisotopic mass
- 302.88944
Names & identifiers
- Preferred name
- 5,7-dibromo-1-methyl-3H-indol-2-one
- IUPAC
- 5,7-dibromo-1-methyl-3H-indol-2-one
Names & synonyms
100831-26-3DTXSID0012417265,7-Dibromo-1,3-dihydro-1-methyl-2H-indol-2-one5,7-Dibromo-1-methyl-1,3-dihydro-2H-indol-2-one
Database identifiers
- CAS
100831-26-3- PubChem CID
- 85522178
- DTXSID
DTXSID001241726
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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