Basic information
- CAS
33692-99-8- Standard SMILES
CCC(C)Nc1nc(Cl)nc(NC)n1- InChIKey
IVZLDYZLLPSSPU-UHFFFAOYSA-N- Molecular formula
- C8H14ClN5
- Average molar mass
- 215.68 g/mol
- Monoisotopic mass
- 215.0937732
Names & identifiers
- Preferred name
- 2-Chloro-4-(methylamino)-6-(sec-butylamino)-s-triazine
- IUPAC
- 2-N-butan-2-yl-6-chloro-4-N-methyl-1,3,5-triazine-2,4-diamine
Names & synonyms
33692-99-82-Chloro-4-(methylamino)-6-(sec-butylamino)-s-triazineN2-(sec-Butyl)-6-chloro-N4-methyl-1,3,5-triazine-2,4-diamineGS 18182starbld00288042-N-butan-2-yl-6-chloro-4-N-methyl-1,3,5-triazine-2,4-diamineDTXSID60955305AKOS019334117N~2~-(Butan-2-yl)-6-chloro-N~4~-methyl-1,3,5-triazine-2,4(1H,3H)-diimine
Database identifiers
- CAS
33692-99-8- PubChem CID
- 36583
- DTXSID
DTXSID60955305- Nikkaji
- J1.617.020H
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 168
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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