Basic information
- CAS
916-94-9- Standard SMILES
Cc1cccc2ccc3cc4ccccc4cc3c12.O=C1c2cc([N+](=O)[O-])cc(I)c2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]- InChIKey
DCKGEIAXDYIJQH-UHFFFAOYSA-N- Molecular formula
- C32H18IN3O7
- Average molar mass
- 683.4 g/mol
- Monoisotopic mass
- 683.01895
Names & identifiers
- Preferred name
- 4-Iodo-2,5,7-trinitro-9h-fluoren-9-one-1-methyltetraphene(1:1)
- IUPAC
- 4-iodo-2,5,7-trinitrofluoren-9-one;1-methylbenzo[a]anthracene
Names & synonyms
916-94-94-iodo-2,5,7-trinitro-9h-fluoren-9-one- 1-methyltetraphene(1:1)NSC97626DTXSID50294679NSC-976264-Iodo-2,5,7-trinitro-9H-fluoren-9-one--1-methyltetraphene (1/1)
Database identifiers
- CAS
916-94-9- PubChem CID
- 263241
- DTXSID
DTXSID50294679
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 918
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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