1,2,3-Benzothiadiazole, 6-methyl-
Basic information
- CAS
53034-68-7- Standard SMILES
Cc1ccc2nnsc2c1- InChIKey
ARGLHVHBIBSIAD-UHFFFAOYSA-N- Molecular formula
- C7H6N2S
- Average molar mass
- 150.2 g/mol
- Monoisotopic mass
- 150.02516937
Names & identifiers
- Preferred name
- 1,2,3-Benzothiadiazole, 6-methyl-
- IUPAC
- 6-methyl-1,2,3-benzothiadiazole
Names & synonyms
53034-68-71,2,3-Benzothiadiazole, 6-methyl-DTXSID10356181RefChem:214608DTXCID203072406-methyl-1,2,3-benzothiadiazole6-methyl benzothiadiazoleAcibenzolar Acid Impurity 29SCHEMBL7576448AO-289/42804203
Database identifiers
- CAS
53034-68-7- PubChem CID
- 820258
- DTXSID
DTXSID10356181- Nikkaji
- J2.189.814G
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 129
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Related reactions
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Compound notes
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