Basic information
- CAS
25314-99-2- Standard SMILES
COc1ccc2c([N+](=O)[O-])c(OC)ccc2c1Br- InChIKey
IJYZMNVYZUFQFI-UHFFFAOYSA-N- Molecular formula
- C12H10BrNO4
- Average molar mass
- 312.12 g/mol
- Monoisotopic mass
- 310.97932
Names & identifiers
- Preferred name
- 1-Bromo-2,6-dimethoxy-5-nitronaphthalene
- IUPAC
- 1-bromo-2,6-dimethoxy-5-nitronaphthalene
- English name
- 1-Bromo-2,6-dimethoxy-5-nitronaphthalene
- Molecular formula
- C12H10BrNO4
- Molecular weight
- 312.12
Names & synonyms
1-Bromo-2,6-dimethoxy-5-nitronaphthalene25314-99-2DTXSID60347963RefChem:228309DTXCID202990351-Bromo-5-nitro-2,6-dimethoxynaphthaleneNaphthalene, 1-bromo-2,6-dimethoxy-5-nitro-IJYZMNVYZUFQFI-UHFFFAOYSA-N1-Bromo-2,6-dimethoxy-5-nitronaphthalene #
Database identifiers
- CAS
25314-99-2- PubChem CID
- 628656
- DTXSID
DTXSID60347963- Nikkaji
- J119.688J
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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