Ethyl 2-[(1R)-1-{[(Benzyloxy)Carbonyl]Amino}-2-Methylpropyl]-1,3-Thiazole-4-Carboxylate

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Properties Simple | Detailed

Formula C18H22N2O4S
IUPAC Name ethyl 2-[(1r)-1-(benzyloxycarbonylamino)-2-methyl-propyl]thiazole-4-carboxylate
Molecular Mass 362.443 g·mol−1
Heat of Formation -540.1 ± 16.7 kJ·mol−1
Dipole Moment 0.97 ± 1.08 D
Volume 440.33 Å 3
Surface Area 388.72 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 1.79 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(1r)-1-(benzyloxycarbonylamino)-2-methyl-propyl]thiazole-4-carboxylic acid ethyl ester
  • 2-[(1r)-2-methyl-1-[[oxo-(phenylmethoxy)methyl]amino]propyl]-4-thiazolecarboxylic acid ethyl ester
  • 4-thiazolecarboxylic acid, 2-(2-methyl-1-(((phenylmethoxy)carbonyl)amino)propyl)-, ethyl ester, (r)-
  • d-val thiazole
  • d-val-thz
  • ethyl (r)-2-(2-methyl-1-(((phenylmethoxy)carbonyl)amino)propyl)-4-thiazolecarboxylate
  • ethyl 2-[(1r)-2-methyl-1-(phenylmethoxycarbonylamino)propyl]-1,3-thiazole-4-carboxylate
  • ethyl 2-[(1r)-2-methyl-1-(phenylmethoxycarbonylamino)propyl]thiazole-4-carboxylate
  • valine thiazole
CAS Number(s)
  • 117076-27-4
InChIKey XGNQJNTWZUMDCH-OAHLLOKOSA-N
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