N~2~-(Bromoacetyl)-N~5~-(Diaminomethylene)-D-Ornithine

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Properties Simple | Detailed

Formula C8H15BrN4O3
IUPAC Name (2r)-2-[(2-bromoacetyl)amino]-5-guanidino-pentanoic acid
Molecular Mass 295.134 g·mol−1
Heat of Formation -541.8 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 301.54 Å 3
Surface Area 273.33 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-(2-bromoethanoylamino)-5-(diaminomethylideneamino)pentanoic acid
  • (2r)-2-[(2-bromo-1-oxoethyl)amino]-5-guanidinopentanoic acid
  • (2r)-2-[(2-bromoacetyl)amino]-5-(diaminomethylideneamino)pentanoic acid
  • (2r)-2-[(2-bromoacetyl)amino]-5-guanidino-pentanoic acid
  • (2r)-2-[(2-bromoacetyl)amino]-5-guanidino-valeric acid
  • bromoacetyl-d-arginine
  • bromoacetylarginine
  • d-arginine, n2-(bromoacetyl)-
CAS Number(s)
  • 31373-68-9
InChIKey ITHXTSANOXLYDY-RXMQYKEDSA-N
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Elements H C O Br N