4-(Chloromethyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Basic information
- CAS
30357-76-7- Standard SMILES
Nc1nc(CCl)nc(C(Cl)(Cl)Cl)n1- InChIKey
BUDXXQDKXNLYAY-UHFFFAOYSA-N- Molecular formula
- C5H4Cl4N4
- Average molar mass
- 261.9 g/mol
- Monoisotopic mass
- 259.919007
Names & identifiers
- Preferred name
- 4-(Chloromethyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-(chloromethyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-(chloromethyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine30357-76-7SCHEMBL10713503DTXSID60275156
Database identifiers
- CAS
30357-76-7- PubChem CID
- 35000
- DTXSID
DTXSID60275156- Nikkaji
- J1.612.940B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
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Compound notes
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