N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
Basic information
- CAS
30356-71-9- Standard SMILES
Cc1ccc(S(=O)(=O)Nc2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1- InChIKey
CBBOFVRXKCPJSO-UHFFFAOYSA-N- Molecular formula
- C12H8Cl6N4O2S
- Average molar mass
- 485 g/mol
- Monoisotopic mass
- 481.849913
Names & identifiers
- Preferred name
- N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
- IUPAC
- N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
Names & synonyms
N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide30356-71-9DTXSID50275145N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzene-1-sulfonamide
Database identifiers
- CAS
30356-71-9- PubChem CID
- 34977
- DTXSID
DTXSID50275145- Nikkaji
- J1.612.791D
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 531
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Compound notes
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