6-Chloro-3-methylpicolinic acid - CAS 1201924-32-4
Catalog: |
BB004748 |
Product Name: |
6-Chloro-3-methylpicolinic acid |
CAS: |
1201924-32-4 |
Synonyms: |
6-chloro-3-methyl-2-pyridinecarboxylic acid; 6-chloro-3-methylpyridine-2-carboxylic acid |
IUPAC Name: | 6-chloro-3-methylpyridine-2-carboxylic acid |
Description: | 6-Chloro-3-methylpicolinic acid (CAS# 1201924-32-4) is disubstituted pyridinecarboxylic acid used in the preparation of biologically active compounds such as inhibitors of Janus kinases and PDK1. |
Molecular Weight: | 171.58 |
Molecular Formula: | C7H6ClNO2 |
Canonical SMILES: | CC1=C(N=C(C=C1)Cl)C(=O)O |
InChI: | InChI=1S/C7H6ClNO2/c1-4-2-3-5(8)9-6(4)7(10)11/h2-3H,1H3,(H,10,11) |
InChI Key: | ODSPBBWQVLWOPG-UHFFFAOYSA-N |
Purity: | 95 % |
Storage: | Inert atmosphere, 2-8 ℃ |
MDL: | MFCD16249840 |
LogP: | 1.74160 |
Publication Number | Title | Priority Date |
WO-2021057853-A1 | Aza-quinoline compounds and uses thereof | 20190926 |
WO-2021019051-A1 | Inhibitors of human atgl | 20190730 |
WO-2020239999-A1 | SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE | 20190531 |
US-2021300918-A1 | SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE | 20190531 |
US-2020055874-A1 | INHIBITORS OF KEAP1-Nrf2 PROTEIN-PROTEIN INTERACTION | 20180820 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0087061 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0087061 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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