(2S)-2-{[4-Chloro-6-(Ethylamino)-1,3,5-Triazin-2-Yl]Amino}-2-Methylbutanenitrile

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Properties Simple | Detailed

Formula C10H15ClN6
IUPAC Name (2s)-2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-2-methyl-butanenitrile
Molecular Mass 254.719 g·mol−1
Heat of Formation 187.1 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 299.89 Å 3
Surface Area 281.65 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 2.69 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(4-chloro-6-ethylamino-1,3,5-triazin-2-yl)amino]-2-methyl-butanenitrile
  • (2s)-2-[(4-chloro-6-ethylamino-1,3,5-triazin-2-yl)amino]-2-methylbutanenitrile
  • (2s)-2-[(4-chloro-6-ethylamino-s-triazin-2-yl)amino]-2-methyl-butyronitrile
  • 2-chloro-4-ethylamino-6-(s(-)-2'-cyano-4-butylamino)-1,3,5-triazine
  • ceb
  • dg-420314
InChIKey IUCVBFHDSFSEIK-JTQLQIEISA-N
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Elements H C Cl N