Basic information
- CAS
1064-56-8- Standard SMILES
C1=C(c2cccc3ccccc23)CCCC1.O=C1c2cc([N+](=O)[O-])cc(Br)c2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]- InChIKey
VKHFWXIYNICFKT-UHFFFAOYSA-N- Molecular formula
- C29H20BrN3O7
- Average molar mass
- 602.4 g/mol
- Monoisotopic mass
- 601.04846
Names & identifiers
- Preferred name
- 4-Bromo-2,5,7-trinitro-9h-fluoren-9-one-1-(cyclohex-1-en-1-yl)naphthalene(1:1)
- IUPAC
- 4-bromo-2,5,7-trinitrofluoren-9-one;1-(cyclohexen-1-yl)naphthalene
Names & synonyms
1064-56-8NSC976154-bromo-2,5,7-trinitro-9h-fluoren-9-one- 1-(cyclohex-1-en-1-yl)naphthalene(1:1)DTXSID00294669NSC-976154-Bromo-2,5,7-trinitro-9H-fluoren-9-one--1-(cyclohex-1-en-1-yl)naphthalene (1/1)
Database identifiers
- CAS
1064-56-8- PubChem CID
- 263229
- DTXSID
DTXSID00294669
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 861
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…