Basic information
- Standard SMILES
COc1cc2nnnc(S(C)(=O)=O)c2cc1OC- InChIKey
KGOSZHDEFDLCKK-UHFFFAOYSA-N- Molecular formula
- C10H11N3O4S
- Average molar mass
- 269.28 g/mol
Names & identifiers
- Preferred name
- 4-Methanesulfonyl-6,7-dimethoxy-1,2,3-benzotriazine
- IUPAC
- 6,7-dimethoxy-4-methylsulfonyl-1,2,3-benzotriazine
Names & synonyms
SCHEMBL8857492KGOSZHDEFDLCKK-UHFFFAOYSA-N4-methanesulfonyl-6,7-dimethoxy-1,2,3-benzotriazine
Database identifiers
- PubChem CID
- 14713860
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 99.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 383
Related reactions
4 records
Compound notes
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