Basic information
- CAS
6972-60-7- Standard SMILES
Cc1cc2c(cc1C)NC(=O)CC(=O)N2- InChIKey
RUBWPGJFSBXBDJ-UHFFFAOYSA-N- Molecular formula
- C11H12N2O2
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.08987763
Names & identifiers
- Preferred name
- 7,8-Dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione
- IUPAC
- 7,8-dimethyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione
Names & synonyms
6972-60-77,8-Dimethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dioneX9LC1XPB78UNII-X9LC1XPB78NSC 62136NSC-62136DTXSID102200101H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7,8-dimethyl-RefChem:105603DTXCID10142501NSC621367,8-dimethyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione
Show more names
7,8-dimethyl-1H-benzo[b][1,4]diazepine-2,4(3H,5H)-dione7,8-dimethyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2,4-dioneAKOS015969505DB-333657
Database identifiers
- CAS
6972-60-7- PubChem CID
- 247490
- DTXSID
DTXSID10220010- UNII
- X9LC1XPB78
Properties
Computed structural properties
- XLogP
- 1.1
- 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
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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