6-chloro-1,3-benzodioxol-5-amine

6-chloro-1,3-benzodioxol-5-amine bmse012088 - Data

6-chloro-1,3-benzodioxol-5-amine synonyms

Wikipedia:

Graphical representations:

6-chloro-1,3-benzodioxol-5-amine

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Molecular Formula: C7H6ClNO2

Natural Isotopic Abundance Mass: 171.58104000000003

Mono-Isotopic Molecular Masses:

  • C12N14: 171.008706117
  • C13N14: 178.03218998300002
  • C12N15: 172.00574101
  • C13N15: 179.02922487600003

InChI string: InChI=1S/C7H6ClNO2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3,9H2

EU-OPENSCREEN: EOS102810

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)