Cas no 1194375-62-6 (6-(Trifluoromethyl)isoquinoline)

6-(Trifluoromethyl)isoquinoline is a fluorinated heterocyclic compound featuring a trifluoromethyl group at the 6-position of the isoquinoline scaffold. This structural motif imparts enhanced electron-withdrawing properties and metabolic stability, making it valuable in medicinal chemistry and agrochemical research. The trifluoromethyl group improves lipophilicity and bioavailability, while the isoquinoline core offers a versatile platform for further functionalization. Its applications include serving as a key intermediate in the synthesis of pharmaceuticals, ligands for catalysis, and bioactive molecules. The compound’s stability under various reaction conditions and compatibility with cross-coupling reactions further enhance its utility in synthetic organic chemistry.
6-(Trifluoromethyl)isoquinoline structure
1194375-62-6 structure
Product Name:6-(Trifluoromethyl)isoquinoline
CAS No:1194375-62-6
MF:C10H6F3N
MW:197.156552791595
MDL:MFCD11226967
CID:1024273
PubChem ID:20493428
Update Time:2025-05-27

6-(Trifluoromethyl)isoquinoline Chemical and Physical Properties

Names and Identifiers

    • 6-(Trifluoromethyl)isoquinoline
    • AK101361
    • ANW-75157
    • KB-247322
    • MB09809
    • Y5807
    • 1194375-62-6
    • AMY26308
    • AKOS006322883
    • AS-49716
    • Isoquinoline, 6-(trifluoromethyl)-
    • MFCD11226967
    • CS-0215415
    • K10135
    • EN300-245340
    • DTXSID30608053
    • FFXLPXFDDMEXSB-UHFFFAOYSA-N
    • SCHEMBL11139756
    • MDL： MFCD11226967
    • Inchi： 1S/C10H6F3N/c11-10(12,13)9-2-1-8-6-14-4-3-7(8)5-9/h1-6H
    • InChI Key： FFXLPXFDDMEXSB-UHFFFAOYSA-N
    • SMILES： FC(C1C=CC2C=NC=CC=2C=1)(F)F

Computed Properties

  • Exact Mass: 197.04523368g/mol
  • Monoisotopic Mass: 197.04523368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 202
  • 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: 3
  • Topological Polar Surface Area: 12.9?2

6-(Trifluoromethyl)isoquinoline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB511677-500 mg
6-(Trifluoromethyl)isoquinoline; .
 1194375-62-6
500MG
 €860.00 2023-04-18
abcr
AB511677-1 g
6-(Trifluoromethyl)isoquinoline; .
 1194375-62-6
1g
 €1,355.00 2023-04-18
Chemenu
CM145435-250mg
6-(trifluoromethyl)isoquinoline
 1194375-62-6 95%
250mg
 $*** 2023-04-03
Chemenu
CM145435-1g
6-(trifluoromethyl)isoquinoline
 1194375-62-6 95%
1g
 $*** 2023-04-03
Chemenu
CM145435-1g
6-(trifluoromethyl)isoquinoline
 1194375-62-6 95%
1g
 $729 2021-08-05
Alichem
A189004001-1g
6-(Trifluoromethyl)isoquinoline
 1194375-62-6 95%
1g
 $665.68 2023-09-04
eNovation Chemicals LLC
Y1105485-1g
6-(trifluoromethyl)isoquinoline
 1194375-62-6 95%
1g
 $1100 2024-07-23
eNovation Chemicals LLC
D951191-100mg
Isoquinoline, 6-(trifluoromethyl)-
 1194375-62-6 95%
100mg
 $170 2024-06-08
eNovation Chemicals LLC
D951191-250mg
Isoquinoline, 6-(trifluoromethyl)-
 1194375-62-6 95%
250mg
 $265 2024-06-08
Enamine
EN300-245340-0.05g
6-(trifluoromethyl)isoquinoline
 1194375-62-6 95%
0.05g
 $347.0 2024-06-19

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