(2R)-2-[(4S)-4-Amino-4-Carboxybutyl]-2-Aziridinecarboxylic Acid

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Properties Simple | Detailed

Formula C8H14N2O4
IUPAC Name (2r)-2-[(4s)-4-amino-4-carboxy-butyl]aziridine-2-carboxylic acid
Molecular Mass 202.208 g·mol−1
Heat of Formation -651.4 ± 16.7 kJ·mol−1
Dipole Moment 0.88 ± 1.08 D
Volume 245.88 Å 3
Surface Area 234.03 Å 2
HOMO Energy -10.07 ± 0.55 eV
LUMO Energy 3.58 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[(4s)-4-amino-5-hydroxy-5-keto-pentyl]ethylenimine-2-carboxylic acid
  • (2r)-2-[(4s)-4-amino-5-hydroxy-5-oxo-pentyl]aziridine-2-carboxylic acid
  • (2r)-2-[(4s)-4-amino-5-hydroxy-5-oxopentyl]-2-aziridinecarboxylic acid
  • (2r)-2-[(4s)-4-amino-5-hydroxy-5-oxopentyl]aziridine-2-carboxylic acid
InChIKey PZLRXNWCQLUSBF-YLWLKBPMSA-N
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