1,6-Benzodiazocine-2,5-dione, 1,3,4,6-tetrahydro-8-methyl-
Basic information
- CAS
651316-19-7- Standard SMILES
Cc1ccc2c(c1)NC(=O)CCC(=O)N2- InChIKey
SHKOTARLPDVACJ-UHFFFAOYSA-N- Molecular formula
- C11H12N2O2
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.08987763
Names & identifiers
- Preferred name
- 1,6-Benzodiazocine-2,5-dione, 1,3,4,6-tetrahydro-8-methyl-
- IUPAC
- 8-methyl-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione
Names & synonyms
651316-19-71,6-Benzodiazocine-2,5-dione, 1,3,4,6-tetrahydro-8-methyl-8-methyl-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dioneDTXSID60461597
Database identifiers
- CAS
651316-19-7- PubChem CID
- 11298652
- DTXSID
DTXSID60461597
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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