Cas no 1204298-75-8 (6-(Difluoromethyl)isoquinoline)

6-(Difluoromethyl)isoquinoline structure
1204298-75-8 structure
Product Name:6-(Difluoromethyl)isoquinoline
CAS No:1204298-75-8
MF:C10H7F2N
MW:179.166089296341
CID:2197469
PubChem ID:53405933
Update Time:2025-04-21

6-(Difluoromethyl)isoquinoline Chemical and Physical Properties

Names and Identifiers

    • 6-(Difluoromethyl)isoquinoline
    • 1204298-75-8
    • DTXSID201306172
    • DB-333257
    • Inchi: 1S/C10H7F2N/c11-10(12)8-1-2-9-6-13-4-3-7(9)5-8/h1-6,10H
    • InChI Key: VKHUTDGSHKOAGA-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC2C=NC=CC=2C=1)F

Computed Properties

  • Exact Mass: 179.05465555Da
  • Monoisotopic Mass: 179.05465555Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 172
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 12.9?2

6-(Difluoromethyl)isoquinoline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D198165-50mg
6-(Difluoromethyl)isoquinoline
1204298-75-8
50mg
$ 640.00 2022-06-05
TRC
D198165-100mg
6-(Difluoromethyl)isoquinoline
1204298-75-8
100mg
$ 1065.00 2022-06-05
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