Gabapentin

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Properties Simple | Detailed

Formula C9H17NO2
IUPAC Name 2-[1-(aminomethyl)cyclohexyl]acetic acid
Molecular Mass 171.237 g·mol−1
Heat of Formation -505.9 ± 16.7 kJ·mol−1
Dipole Moment 3.62 ± 1.08 D
Volume 221.28 Å 3
Surface Area 199.02 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 3.73 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(aminomethyl)-cyclohexaneacetic acid
  • 1-(aminomethyl)cyclohexaneacetic acid
  • 2-[1-(aminomethyl)cyclohexyl]ethanoic acid
  • [1-(aminomethyl)cyclohexyl]acetic acid
  • aclonium
  • bpbio1_000993
  • ci 945
  • cyclohexaneacetic acid, 1-(aminomethyl)-
  • d00332
  • dds-2003
  • gabapen
  • gabapentin (jan/usan/inn)
  • gabapentin gr
  • gabapentine
  • gabapentino [spanish]
  • gabapetin
  • gbn
  • go 3450
  • goe 2450
  • goe-3450
  • ks-1064
  • ls-7194
  • neurontin
  • tocris-0806
CAS Number(s)
  • 60142-96-3
InChIKey UGJMXCAKCUNAIE-UHFFFAOYSA-N
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