1-Chloro-4-(2-Methyl-2-Nitropropyl)Benzene

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Properties Simple | Detailed

Formula C10H12ClNO2
IUPAC Name 1-chloro-4-(2-methyl-2-nitro-propyl)benzene
Molecular Mass 213.661 g·mol−1
Heat of Formation -75.0 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 252.56 Å 3
Surface Area 226.94 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(4'-chlorophenyl)-2,2-dimethyl-2-nitroethane
  • 1-(4'-chlorophenyl)-2-methyl-2-nitropropane
  • alpha,alpha-dimethyl-alpha-nitro-beta-(4-chlorophenyl)ethane
  • benzene, 1-chloro-4-(2-methyl-2-nitropropyl)-
  • nitrochlorphentermine
CAS Number(s)
  • 52497-66-2
InChIKey YLORHEQBPSTIOL-UHFFFAOYSA-N
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Elements H C N O Cl