N~2~-(3-Chlorobenzoyl)-N-(3,3-Dimethylbutyl)-D-α-Glutamine

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Properties Simple | Detailed

Formula C18H25ClN2O4
IUPAC Name (4r)-4-[(3-chlorobenzoyl)amino]-5-(3,3-dimethylbutylamino)-5-oxo-pentanoic acid
Molecular Mass 368.855 g·mol−1
Heat of Formation -844.4 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 458.3 Å 3
Surface Area 394.6 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-4-[(3-chlorobenzoyl)amino]-5-(3,3-dimethylbutylamino)-5-keto-valeric acid
  • (4r)-4-[(3-chlorobenzoyl)amino]-5-(3,3-dimethylbutylamino)-5-oxo-pentanoic acid
  • (4r)-4-[(3-chlorophenyl)carbonylamino]-5-(3,3-dimethylbutylamino)-5-oxo-pentanoic acid
  • (4r)-4-[[(3-chlorophenyl)-oxomethyl]amino]-5-(3,3-dimethylbutylamino)-5-oxopentanoic acid
  • 4-(3-chlorobenzamido)-5-(3,3-dimethylbutylamino)-5-oxopentanoic acid
  • cr 2093
  • cr-2093
  • pentanoic acid, 4-((3-chlorobenzoyl)amino)-5-((3,3-dimethylbutyl)amino)-5-oxo-, (r)-
CAS Number(s)
  • 136374-73-7
InChIKey VUYSXYHJEIPUTG-CQSZACIVSA-N
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Elements H C N O Cl