Epiroprim

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Properties Simple | Detailed

Formula C19H23N5O2
IUPAC Name 5-[(3,5-diethoxy-4-pyrrol-1-yl-phenyl)methyl]pyrimidine-2,4-diamine
Molecular Mass 353.418 g·mol−1
Heat of Formation -32.8 ± 16.7 kJ·mol−1
Dipole Moment 3.24 ± 1.08 D
Volume 430.3 Å 3
Surface Area 371.46 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4-diamino-5-(3,5-diethoxy-4-n-pyrrolylbenzyl)pyrimidine
  • 2,4-diamino-5-(3,5-diethoxy-4-pyrrol-1-ylbenzyl)pyrimidine
  • 2,4-pyrimidinediamine, 5-((3,5-diethoxy-4-(1h-pyrrol-1-yl)phenyl)methyl)-
  • 5-((3,5-diethoxy-4-(1h-pyrrol-1-yl)phenyl)methyl)-2,4-pyrimidinediamine
  • 5-[(3,5-diethoxy-4-pyrrol-1-yl-phenyl)methyl]pyrimidine-2,4-diamine
  • 5-[(3,5-diethoxy-4-pyrrol-1-ylphenyl)methyl]pyrimidine-2,4-diamine
  • 5-[[3,5-diethoxy-4-(1-pyrrolyl)phenyl]methyl]pyrimidine-2,4-diamine
  • [2-amino-5-(3,5-diethoxy-4-pyrrol-1-yl-benzyl)pyrimidin-4-yl]amine
  • epir
  • ro 11-8958
  • ro-11-8958
CAS Number(s)
  • 73090-70-7
InChIKey NMARPFMJVCXSAV-UHFFFAOYSA-N
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