Basic information
- CAS
2225-40-3- Standard SMILES
CN1C(=O)c2ccccc2NS1(=O)=O- InChIKey
UYQCNKJNSGSECZ-UHFFFAOYSA-N- Molecular formula
- C8H8N2O3S
- Average molar mass
- 212.23 g/mol
- Monoisotopic mass
- 212.0255633
Names & identifiers
- Preferred name
- 1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-methyl-, 2,2-dioxide
- IUPAC
- 3-methyl-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one
- English name
- BENTAZON METHYL DERIVATIVE
- Molecular formula
- C8H8N2O3S
- Molecular weight
- 212.23
Names & synonyms
2225-40-31H-2,1,3-Benzothiadiazin-4(3H)-one, 3-methyl-, 2,2-dioxideSCHEMBL11807174DTXSID50944905UYQCNKJNSGSECZ-UHFFFAOYSA-N1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-methyl-2,2-dioxide3-Methyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide #3-Methyl-2lambda~6~,1,3-benzothiadiazine-2,2,4(1H,3H)-trione3-Methyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide3-Methyl-3,4-dihydro-4-oxo-1H-2,1,3-benzothiadiazine 2,2-dioxide
Database identifiers
- CAS
2225-40-3- PubChem CID
- 16684
- DTXSID
DTXSID50944905
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 346
Chemistry & industry
Suppliers1 total
BOC Sciences16314854226; +8616314854226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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