(2S)-1-(5-Methyl-2-Nitrophenoxy)-3-[(2-Methyl-2-Propanyl)Amino]-2-Propanol

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Properties Simple | Detailed

Formula C14H22N2O4
IUPAC Name (2s)-1-(tert-butylamino)-3-(5-methyl-2-nitro-phenoxy)propan-2-ol
Molecular Mass 282.335 g·mol−1
Heat of Formation -421.7 ± 16.7 kJ·mol−1
Dipole Moment 6.53 ± 1.08 D
Volume 350.94 Å 3
Surface Area 308.31 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-(tert-butylamino)-3-(5-methyl-2-nitro-phenoxy)propan-2-ol
  • (2s)-1-(tert-butylamino)-3-(5-methyl-2-nitrophenoxy)propan-2-ol
InChIKey AZNIRKSODOTVDW-NSHDSACASA-N
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