Pterin

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Properties Simple | Detailed

Formula C6H5N5O
IUPAC Name 2-amino-1h-pteridin-4-one
Molecular Mass 163.137 g·mol−1
Heat of Formation 150.2 ± 16.7 kJ·mol−1
Dipole Moment 7.06 ± 1.08 D
Volume 171.97 Å 3
Surface Area 174.66 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 1.71 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-1h-pteridin-4-one
  • 2-amino-4(1h)-pteridinone
  • 2-amino-4(3h)-pteridinone
  • 2-amino-4-hydroxypteridine
  • 2-amino-4-oxodihydropteridine
  • 2-amino-4-oxopteridine
  • 2-amino-4-pteridinol
  • 2-amino-4-pteridone
  • 2-aminopteridin-4(1h)-one
  • 2-aminopteridin-4(3h)-one
  • 2-aminopteridin-4-ol
  • 4(1h)-pteridinone, 2-amino-
  • 4(3h)-pteridinone, 2-amino-
  • 4-oxopterin
  • oprea1_553855
  • pteridoxamine
  • pterin (van)
  • pterine
  • quinonoid dihydropterin, 2-amino-
CAS Number(s)
  • 2236-60-4
  • 100643-15-0
  • 27839-95-8
  • 938-42-1
InChIKey HNXQXTQTPAJEJL-UHFFFAOYSA-N
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