6-Amino-2-Sulfanylpyrimidin-4-Ol

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Properties Simple | Detailed

Formula C4H5N3OS++
IUPAC Name 6-amino-2-thioxo-pyrimidin-4-one
Molecular Mass 143.167 g·mol−1
Heat of Formation -65.0 ± 16.7 kJ·mol−1
Dipole Moment 7.07 ± 1.08 D
Volume 154.59 Å 3
Surface Area 160.7 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry Cs
Synonyms
  • 106651-79-0 (deleted)
  • 197175-00-1 (deleted)
  • 2-mercapto-6-aminouracil
  • 2-thio-6-aminouracil
  • 333-57-3 (deleted)
  • 4(1h)-pyrimidinone, 6-amino-2,3-dihydro-2-thioxo-
  • 4-amino-2-thiouracil
  • 4-amino-6-hydroxy-2-mercaptopyrimidine
  • 6-amino-2-thiouracil
  • 6-amino-2-thioxo-1h-pyrimidin-4-one
  • 6-amino-4-keto-2-thiopyrimidine
  • 6-aminothiouracil
  • ab 48
  • ac-907/25014370
  • oprea1_231185
  • t0509-0036
  • uracil, 6-amino-2-thio-
CAS Number(s)
  • 1004-40-6
InChIKey YFYYRKDBDBILSD-UHFFFAOYSA-N
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