1-(4,6-Dimethyl-3-pyridyl)ethanone - CAS 108028-67-7
Catalog: |
BB002157 |
Product Name: |
1-(4,6-Dimethyl-3-pyridyl)ethanone |
CAS: |
108028-67-7 |
Synonyms: |
1-(4,6-dimethyl-3-pyridinyl)ethanone; 1-(4,6-dimethylpyridin-3-yl)ethanone |
IUPAC Name: | 1-(4,6-dimethylpyridin-3-yl)ethanone |
Description: | 1-(4,6-Dimethyl-3-pyridyl)ethanone (CAS# 108028-67-7) is a useful research chemical. |
Molecular Weight: | 149.19 |
Molecular Formula: | C9H11NO |
Canonical SMILES: | CC1=CC(=NC=C1C(=O)C)C |
InChI: | InChI=1S/C9H11NO/c1-6-4-7(2)10-5-9(6)8(3)11/h4-5H,1-3H3 |
InChI Key: | JSVYKRABSVRQRH-UHFFFAOYSA-N |
LogP: | 1.90100 |
Publication Number | Title | Priority Date |
US-2017145034-A1 | Alkynyl alcohols and methods of use | 20130822 |
US-2011005947-A1 | Inhibitors of jak | 20090506 |
US-2013137673-A1 | Inhibitors of jak | 20090506 |
US-8367689-B2 | Inhibitors of JAK | 20090506 |
US-8853230-B2 | Inhibitors of JAK | 20090506 |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 149.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.084063974 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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