(7S)-2-Amino-6-(Hydroxymethyl)-7-Methyl-7-(2-Phenylethyl)-7,8-Dihydro-4(1H)-Pteridinone

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Properties Simple | Detailed

Formula C16H19N5O2+
IUPAC Name (7s)-2-amino-6-(hydroxymethyl)-7-methyl-7-(2-phenylethyl)-8h-pteridin-4-one
Molecular Mass 313.354 g·mol−1
Heat of Formation -132.7 ± 16.7 kJ·mol−1
Dipole Moment 7.76 ± 1.08 D
Volume 372.33 Å 3
Surface Area 330.05 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 2.45 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-6-hydroxymethyl-7-methyl-7-phenethyl-7,8-dihydro-3h-pteridin-4-one
  • 7,8-dihydro-6-hydroxymethyl-7-methyl-7-[2-phenylethyl]-pterin
  • 87y
InChIKey XMFJTCGUDFSWSW-INIZCTEOSA-N
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