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Home> Hot Product Listed 1   > (1-(2-fluorophenyl)cyclopropyl)methanamine hydrochloride
14596-52-2 structure

(1-(2-fluorophenyl)cyclopropyl)methanamine hydrochloride

Iupac Name:1-ethylpyridin-1-ium-3-carboxamide;chloride
CAS No.:14596-52-2
Molecular Weight:186.639
Molecular Formula:C15H15FN2O2S (isomer)
Names and Identifiers
Synonyms

(1-(2-Fluorophenyl)cyclopropyl)methanamine hydrochloride [1-(2-fluorophenyl)cyclopropyl]methanamine hydrochloride 1-[1-(2-fluorophenyl)cyclopropyl]methanamine hydrochloride 1-[1-(2-fluorophenyl)cyclopropyl]methanamine--hydrogen chloride (1/1) AK141436 AKOS015847438 AX8281613 BG00306845 csmbplixifjadv-uhfffaoysa-n CTK8C6546 CyclopropaneMethanaMine, 1-(2-fluorophenyl)-, hydrochloride DTXSID10676437 TC-062805

Inchi
InChI=1S/C8H10N2O.ClH/c1-2-10-5-3-4-7(6-10)8(9)11;/h3-6H,2H2,1H3,(H-,9,11);1H
InChkey
PVXGLLAJVUMKTG-UHFFFAOYSA-N
Canonical Smiles
CC[N+]1=CC=CC(=C1)C(=O)N.[Cl-]
Computational chemical data
  • Molecular Weight:186.639g/mol
  • Molecular Formula:C15H15FN2O2S
  • Compound Is Canonicalized:True
  • Exact Mass:186.056
  • Monoisotopic Mass:186.056
  • Complexity:147
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:47A^2
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADccBzIAAEAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHgAQAAAADADBmgQ+gJNMEACo AjF3VACCgCA1AiAI2CE4ZNgIIPrA1ZGEIYhggADIycYYAQAMAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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