Zoxazolamine

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Properties Simple | Detailed

Formula C7H5ClN2O
IUPAC Name 5-chloro-1,3-benzoxazol-2-amine
Molecular Mass 168.580 g·mol−1
Heat of Formation 34.9 ± 16.7 kJ·mol−1
Dipole Moment 4.81 ± 1.08 D
Volume 174.61 Å 3
Surface Area 178.08 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry Cs
Synonyms
  • (5-chloro-1,3-benzoxazol-2-yl)amine
  • 2-amino-5-chlorobenzoxazole
  • 2-benzoxazolamine, 5-chloro-
  • 2-benzoxazolamine, 5-chloro- (9ci)
  • 5-chloro-2-benzoxazolamine
  • bcbcmap01_000023
  • benzoxazole, 2-amino-5-chloro-
  • bpbio1_000369
  • contrazole
  • deflexol
  • flexilon
  • flexin
  • mcn-485
  • smp1_000323
  • usaf ma-12
  • zossazolamina [dcit]
  • zoxamin
  • zoxazolamine [ban:inn]
  • zoxine
CAS Number(s)
  • 61-80-3
InChIKey YGCODSQDUUUKIV-UHFFFAOYSA-N
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Elements H C N O Cl