4-(Benzylsulfanyl)-3-Methyl-1-Phenyl-1H-Pyrazol-5-Amine

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Properties Simple | Detailed

Formula C17H17N3S
IUPAC Name 4-benzylsulfanyl-5-methyl-2-phenyl-pyrazol-3-amine
Molecular Mass 295.402 g·mol−1
Heat of Formation 372.1 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 361.41 Å 3
Surface Area 325.84 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • 1-phenyl-3-methyl-4-benzylthio-5-aminopyrazole
  • 1h-pyrazol-5-amine, 3-methyl-1-phenyl-4-((phenylmethyl)thio)-
  • 5-methyl-2-phenyl-4-(phenylmethylsulfanyl)pyrazol-3-amine
  • 5-methyl-2-phenyl-4-(phenylmethylthio)-3-pyrazolamine
  • [4-(benzylthio)-5-methyl-2-phenyl-pyrazol-3-yl]amine
CAS Number(s)
  • 32585-83-4
InChIKey CLHYSODGWZFMGN-UHFFFAOYSA-N
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