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Home> Encyclopedia > Hot Product Listed 6   > 6H-Pyrazolo[3,4-c]pyridine-3,6-dicarboxylicacid, 1,4,5,7-tetrahydro-, 6-(1,1-dimethylethyl) ester
261763-36-4 structure

6H-Pyrazolo[3,4-c]pyridine-3,6-dicarboxylicacid, 1,4,5,7-tetrahydro-, 6-(1,1-dimethylethyl) ester

Iupac Name:2,6-difluoro-3-methylbenzamide
CAS No.:261763-36-4
Molecular Weight:171.147
Molecular Formula:C7H5NS2 (isomer)
Names and Identifiers
Synonyms

6-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine-3-carboxylic acid

Inchi
InChI=1S/C8H7F2NO/c1-4-2-3-5(9)6(7(4)10)8(11)12/h2-3H,1H3,(H2,11,12)
InChkey
WTFLDSNCRFCSAI-UHFFFAOYSA-N
Canonical Smiles
CC1=C(C(=C(C=C1)F)C(=O)N)F
Properties
Density
1.469
Computational chemical data
  • Molecular Weight:171.147g/mol
  • Molecular Formula:C7H5NS2
  • Compound Is Canonicalized:True
  • Exact Mass:171.05
  • Monoisotopic Mass:171.05
  • Complexity:186
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • 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:1
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Recommended Suppliers
  • Tel:+31 (0)20 611 31 33
  • Fax:+31 (0)20 613 75 96
  • Tel:1 888 463 6346
  • Fax:(908) 359-1179
  • Tel:803 788-9494 All other calls
  • Fax:803 788-9419 All other faxes
  • Tel:(33) 4 70 03 88 55
  • Fax:(33) 4 70 03 82 60
  • Tel:1372 360896
  • Fax:1372 360790
 
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