Basic information
- Standard SMILES
COc1ccc(C)c([N+](=O)[O-])c1[N+](=O)[O-]- InChIKey
SRDNGOLAALAPGA-UHFFFAOYSA-N- Molecular formula
- C8H8N2O5
- Average molar mass
- 212.16 g/mol
Names & identifiers
- Preferred name
- 4-Methoxy-2,3-dinitrotoluene
- IUPAC
- 1-methoxy-4-methyl-2,3-dinitrobenzene
Names & synonyms
27077-78-74-methyl-2,3-dinitroanisole4-methoxy-2,3-dinitrotolueneSCHEMBL2309314SRDNGOLAALAPGA-UHFFFAOYSA-NAT486591-methoxy-4-methyl-2,3-dinitrobenzene1-methoxy-4-methyl-2,3-dinitro-benzeneDB-340345
Database identifiers
- PubChem CID
- 12238293
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Related reactions
2 records
Compound notes
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