Cas no 1035700-01-6 (6,7-Dimethoxyquinoline-4-carbonitrile)

6,7-Dimethoxyquinoline-4-carbonitrile structure
1035700-01-6 structure
Product Name:6,7-Dimethoxyquinoline-4-carbonitrile
CAS No:1035700-01-6
MF:C12H10N2O2
MW:214.220002651215
CID:2125291
Update Time:2023-08-04

6,7-Dimethoxyquinoline-4-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 6,7-dimethoxy-4-Quinolinecarbonitrile
    • 6,7-dimethoxyquinoline-4-carbonitrile
    • CMSQCVJWOZVATG-UHFFFAOYSA-N
    • 6,7-Dimethoxyquinoline-4-carbonitrile
    • Inchi: 1S/C12H10N2O2/c1-15-11-5-9-8(7-13)3-4-14-10(9)6-12(11)16-2/h3-6H,1-2H3
    • InChI Key: CMSQCVJWOZVATG-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC2C(=C(C#N)C=CN=2)C=1)OC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 286
  • Topological Polar Surface Area: 55.1
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