4-Methyl-1,3-Dihydro-2H-Benzimidazole-2-Thione

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Properties Simple | Detailed

Formula C8H8N2S
IUPAC Name 4-methylbenzimidazole-1,3-diium-2-thione
Molecular Mass 164.228 g·mol−1
Heat of Formation 163.7 ± 16.7 kJ·mol−1
Dipole Moment 5.64 ± 1.08 D
Volume 190.76 Å 3
Surface Area 190.8 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy 2.20 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3-dihydro-4(or 5)-methyl-2h-benzimidazole-2-thione
  • 2-mercapto-4(or 5)-methylbenzimidazole
  • 2-mercaptomethylbenzimidazole
  • 2-mercaptotoluimidazole
  • 2-mmbi
  • 2h-benzimidazole-2-thione, 1,3-dihydro-4(or 5)-methyl-
  • 2h-benzimidazole-2-thione, 1,3-dihydro-4-methyl-
  • 4(or 5)-methyl-2-mercaptobenzimidazole
  • 4-methyl-1,3-dihydrobenzimidazole-2-thione
  • 4-methyl-2-mercaptobenzimidazole
  • methylmercaptobenzimidazole
  • nocrac mmb
  • vanox mti
  • vulkanox mb 2
CAS Number(s)
  • 27231-33-0
  • 53988-10-6
  • 64588-63-2
InChIKey UDQCDDZBBZNIFA-UHFFFAOYSA-N
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