(1S,2S)-2-Methyl-1-(2H-Tetrazol-5-Yl)-1-Butanamine

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Properties Simple | Detailed

Formula C6H13N5
IUPAC Name (1s,2s)-2-methyl-1-(2h-tetrazol-5-yl)butan-1-amine
Molecular Mass 155.201 g·mol−1
Heat of Formation 232.7 ± 16.7 kJ·mol−1
Dipole Moment 2.34 ± 1.08 D
Volume 200.96 Å 3
Surface Area 190.26 Å 2
HOMO Energy -9.68 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,2s)-2-methyl-1-(2h-1,2,3,4-tetrazol-5-yl)butan-1-amine
  • 1h-tetrazole-5-methanamine, alpha-(1-methylpropyl)-, (s-(r*,r*))-
  • [(1s,2s)-2-methyl-1-(2h-tetrazol-5-yl)butyl]amine
  • isoleucine tetrazole
  • l-5(1-amino-2-methylbutyl)tetrazole
CAS Number(s)
  • 56943-00-1
InChIKey MBPGSKUSSWDBFL-WHFBIAKZSA-N
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Elements H C N