Basic information
- CAS
27977-29-3- Standard SMILES
CC1=C(N=[N+]=[N-])C(=O)C(C)=C(N=[N+]=[N-])C1=O- InChIKey
GGMDMXNKTIDKES-UHFFFAOYSA-N- Molecular formula
- C8H6N6O2
- Average molar mass
- 218.17 g/mol
- Monoisotopic mass
- 218.05522346
Names & identifiers
- Preferred name
- 2,5-Diazido-3,6-dimethylcyclohexa-2,5-diene-1,4-dione
- IUPAC
- 2,5-diazido-3,6-dimethylcyclohexa-2,5-diene-1,4-dione
Names & synonyms
2,5-diazido-3,6-dimethylcyclohexa-2,5-diene-1,4-dione27977-29-3DTXSID20398294RefChem:247259DTXCID50349153NSC110653NSC-110653
Database identifiers
- CAS
27977-29-3- PubChem CID
- 3968209
- DTXSID
DTXSID20398294
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 493
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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