4-(2-Methyl-2-Propanyl)Phenyl 1-Carbamimidoyl-4-Piperidinecarboxylate

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Properties Simple | Detailed

Formula C17H25N3O2
IUPAC Name (4-tert-butylphenyl) 1-carbamimidoylpiperidine-4-carboxylate
Molecular Mass 303.399 g·mol−1
Heat of Formation -276.6 ± 16.7 kJ·mol−1
Dipole Moment 5.05 ± 1.08 D
Volume 387.56 Å 3
Surface Area 334.79 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • 1-amidinoisonipecotic acid (4-tert-butylphenyl) ester
  • 1-carbamimidoyl-4-piperidinecarboxylic acid (4-tert-butylphenyl) ester
  • 4-(1,1-dimethylethyl)phenyl 1-(aminoiminomethyl)-4-piperidinecarboxylate
  • 4-piperidinecarboxylic acid, 1-(aminoiminomethyl)-, 4-(1,1-dimethylethyl)phenyl ester
  • amidinopiperidine-4-carboxylic acid 4-tert-butylphenyl ester
  • apcabe
CAS Number(s)
  • 91283-32-8
InChIKey PYIOOFVHKMDWER-UHFFFAOYSA-N
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