Tcmdc-123931

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Properties Simple | Detailed

Formula C11H11Cl2N4
IUPAC Name 5-(3,4-dichlorophenyl)-6-methyl-pyrimidine-1,3-diium-5-ide-2,4-diamine
Molecular Mass 270.138 g·mol−1
Heat of Formation 104.4 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 288.27 Å 3
Surface Area 263.64 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • 197u50
  • 2,4-diamino-5-(3',4'-dichlorophenyl)-6-methyl pyrimidine
  • 2,4-diamino-5-(3,4-dichlorophenyl)-6-methylpyrimidine
  • 2,4-pyrimidinediamine, 5-(3,4-dichlorophenyl)-6-methyl-
  • 5-(3,4-dichlorophenyl)-6-methyl-2,4-pyrimidinediamine
  • 5-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine
  • 5-(3,4-dichlorphenyl)-6-methyl-2,4-pyrimidindiamin
  • [2-amino-5-(3,4-dichlorophenyl)-6-methyl-pyrimidin-4-yl]amine
  • bw 197 u
  • bw 197u
  • bw 50-197
  • bw 50197
  • bw-197u
  • bw50197
  • c2m
  • d00309
  • ddmp
  • methodichlorophen
  • metoprine
  • metoprine (usan)
  • metoprine, methodichlorophen
  • neuro_000005
  • pyrimidine, 2,4-diamino-5-(3,4-dichlorophenyl)-6-methyl-
  • sk 5265
  • u 197
  • u-197
CAS Number(s)
  • 7761-45-7
InChIKey VQJHOPSWBGJHQS-UHFFFAOYSA-N
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Elements H C N Cl