1H-1,4-Diazepine-5,7(2H,6H)-dione, dihydro-6,6-diethyl-
Basic information
- CAS
61495-84-9- Standard SMILES
CCC1(CC)C(=O)NCCNC1=O- InChIKey
DMXGDHINDUZNDJ-UHFFFAOYSA-N- Molecular formula
- C9H16N2O2
- Average molar mass
- 184.24 g/mol
- Monoisotopic mass
- 184.12117776
Names & identifiers
- Preferred name
- 1H-1,4-Diazepine-5,7(2H,6H)-dione, dihydro-6,6-diethyl-
- IUPAC
- 6,6-diethyl-1,4-diazepane-5,7-dione
Names & synonyms
1H-1,4-Diazepine-5,7(2H,6H)-dione, dihydro-6,6-diethyl-61495-84-9BRN 0144347Dihydro-6,6-diethyl-1H-1,4-diazepine-5,7(2H,6H)-dioneDTXSID602104614-24-00-01154 (Beilstein Handbook Reference)RefChem:237162DTXCID601329526,6-diethyl-1,4-diazepane-5,7-dioneNSC134462NSC-134462
Database identifiers
- CAS
61495-84-9- PubChem CID
- 281607
- DTXSID
DTXSID60210461
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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