2H-Tetrazole, 5-(3,5-Dichloro-4-((5-(3-Methyl-5-Isoxazolyl)Pentyl)Oxy)Phenyl)-2-Methyl-

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Properties Simple | Detailed

Formula C17H19Cl2N5O2
IUPAC Name 5-[3,5-dichloro-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]phenyl]-2-methyltetrazole
Molecular Mass 396.271 g·mol−1
Heat of Formation 163.9 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 443.63 Å 3
Surface Area 412.47 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(3,5-dichloro-4-((5-(3-methyl-5-isoxazolyl)pentyl)oxy)phenyl)-2-methyl-2h-tetrazole
  • 5-[3,5-dichloro-4-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]phenyl]-2-methyl-1,2,3,4-tetrazole
  • 5-[3,5-dichloro-4-[5-(3-methyl-5-isoxazolyl)pentoxy]phenyl]-2-methyltetrazole
  • 5-[3,5-dichloro-4-[5-(3-methylisoxazol-5-yl)pentoxy]phenyl]-2-methyl-tetrazole
  • dmipopmt
  • isoxazole, 5-[5-[2,6-dichloro-4-(2-methyl-2h-tetrazol-5-yl)phenoxy]pentyl]-3-methyl-
CAS Number(s)
  • 107311-86-4
InChIKey SPGRSSKFZLJNIU-UHFFFAOYSA-N
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Elements H C N O Cl