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Home> Hot Product Listed T   > T6679062
19918-36-6 structure

T6679062

Iupac Name:2-(trifluoromethyl)-3H-imidazo[4,5-c]pyridine
CAS No.:19918-36-6
Molecular Weight:187.125
Molecular Formula:C12H16N2O4S (isomer)
Names and Identifiers
Synonyms

3-(5-{[1-(4-fluorophenyl)ethyl]sulfanyl}-4-[(furan-2-yl)methyl]-4h-1,2,4-triazol-3-yl)propanamide MCULE-2426296942 MOLPORT-009-167-154 Z269750912

Inchi
InChI=1S/C7H4F3N3/c8-7(9,10)6-12-4-1-2-11-3-5(4)13-6/h1-3H,(H,12,13)
InChkey
ATGHGGBCGLFTCY-UHFFFAOYSA-N
Canonical Smiles
C1=CN=CC2=C1N=C(N2)C(F)(F)F
Properties
Vapour
0.002mmHg at 25°C
Refractive Index
1.565
Computational chemical data
  • Molecular Weight:187.125g/mol
  • Molecular Formula:C12H16N2O4S
  • Compound Is Canonicalized:True
  • XLogP3-AA:0.9
  • Exact Mass:187.036
  • Monoisotopic Mass:187.036
  • Complexity:194
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Heavy Atom Count:13
  • 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:1
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