2-Chloro-3,6-dimethylpyridine - CAS 72093-14-2
Catalog: |
BB034538 |
Product Name: |
2-Chloro-3,6-dimethylpyridine |
CAS: |
72093-14-2 |
Synonyms: |
2-chloro-3,6-dimethylpyridine; 2-chloro-3,6-dimethylpyridine |
IUPAC Name: | 2-chloro-3,6-dimethylpyridine |
Description: | 2-Chloro-3,6-dimethylpyridine (CAS# 72093-14-2) is used as a reactant in the preparation of resorcinol N-aryl amide compounds as pyruvate dehydrogenase kinase inhibitors. |
Molecular Weight: | 141.60 |
Molecular Formula: | C7H8ClN |
Canonical SMILES: | CC1=C(N=C(C=C1)C)Cl |
InChI: | InChI=1S/C7H8ClN/c1-5-3-4-6(2)9-7(5)8/h3-4H,1-2H3 |
InChI Key: | XUBFMNFNLIDSCP-UHFFFAOYSA-N |
Boiling Point: | 200.8 °C at 760 mmHg |
Density: | 1.113 g/cm3 |
LogP: | 2.35180 |
Publication Number | Title | Priority Date |
WO-2021126729-A1 | Prmt5 inhibitors | 20191217 |
WO-2021017069-A1 | Pyrrolopyrazole derivative, preparation method therefor, and application thereof in medicine | 20190726 |
TW-202038967-A | Neuroactive steroids and compositions thereof | 20181221 |
TW-202000659-A | Piperidinyl-3-(aryloxy)propanamides and propanoates | 20180301 |
US-2020061041-A1 | Piperidinyl-3-(aryloxy)propanamides and propanoates | 20180301 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.034527 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.034527 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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