Cas no 1202006-83-4 (6,7-difluoro-1-methoxyisoquinoline)
6,7-Difluoro-1-methoxyisoquinoline is a fluorinated isoquinoline derivative with notable utility in pharmaceutical and agrochemical research. The difluoro substitution at the 6 and 7 positions enhances its metabolic stability and lipophilicity, making it a valuable intermediate in drug discovery. The methoxy group at the 1-position further modulates reactivity, allowing selective functionalization for targeted synthesis. This compound is particularly useful in the development of kinase inhibitors and bioactive heterocycles due to its electron-withdrawing fluorine atoms, which improve binding affinity and pharmacokinetic properties. Its high purity and well-characterized structure ensure reliability in complex synthetic applications.
1202006-83-4 structure
Product Name:6,7-difluoro-1-methoxyisoquinoline
CAS No:1202006-83-4
MF:C10H7F2NO
MW:195.165489435196
CID:2625101
PubChem ID:58380820
Update Time:2025-05-28
6,7-difluoro-1-methoxyisoquinoline Chemical and Physical Properties
Names and Identifiers
-
- DTXSID80729161
- SCHEMBL2240307
- 6,7-DIFLUORO-1-METHOXYISOQUINOLINE
- 1202006-83-4
- 6,7-difluoro-1-methoxyisoquinoline
-
- MDL: MFCD18374921
- Inchi: 1S/C10H7F2NO/c1-14-10-7-5-9(12)8(11)4-6(7)2-3-13-10/h2-5H,1H3
- InChI Key: WUADJBNCRHFUQQ-UHFFFAOYSA-N
- SMILES: FC1C(=CC2C=CN=C(C=2C=1)OC)F
Computed Properties
- Exact Mass: 195.04957017g/mol
- Monoisotopic Mass: 195.04957017g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 203
- 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: 2.6
- Topological Polar Surface Area: 22.1?2
6,7-difluoro-1-methoxyisoquinoline Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM223557-1g |
6,7-Difluoro-1-methoxyisoquinoline |
1202006-83-4 | 95% | 1g |
$750 | 2021-08-04 | |
| Alichem | A189009447-1g |
6,7-Difluoro-1-methoxyisoquinoline |
1202006-83-4 | 95% | 1g |
$853.45 | 2023-09-04 | |
| Chemenu | CM223557-1g |
6,7-Difluoro-1-methoxyisoquinoline |
1202006-83-4 | 95% | 1g |
$*** | 2023-04-03 |
6,7-difluoro-1-methoxyisoquinoline Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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