Basic information
- CAS
1523-09-7- Standard SMILES
CC(=O)Oc1c([N+](=O)[O-])cccc1[N+](=O)[O-]- InChIKey
FNOLBMVTCDXXSP-UHFFFAOYSA-N- Molecular formula
- C8H6N2O6
- Average molar mass
- 226.14 g/mol
- Monoisotopic mass
- 226.02258592
Names & identifiers
- Preferred name
- (2,6-Dinitrophenyl) acetate
- IUPAC
- (2,6-dinitrophenyl) acetate
Names & synonyms
1523-09-7(2,6-dinitrophenyl) acetateNSC294823SCHEMBL6201135DTXSID603154852,6-DINITROPHENYL ACETATENSC-294823
Database identifiers
- CAS
1523-09-7- PubChem CID
- 325697
- DTXSID
DTXSID60315485
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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