2-(Chloromethyl)-5-(trifluoromethyl)pyridine - CAS 128790-14-7
Catalog: |
BB006936 |
Product Name: |
2-(Chloromethyl)-5-(trifluoromethyl)pyridine |
CAS: |
128790-14-7 |
Synonyms: |
2-(chloromethyl)-5-(trifluoromethyl)pyridine; 2-(chloromethyl)-5-(trifluoromethyl)pyridine |
IUPAC Name: | 2-(chloromethyl)-5-(trifluoromethyl)pyridine |
Description: | 2-(Chloromethyl)-5-(trifluoromethyl)pyridine (CAS# 128790-14-7) is a useful research chemical. |
Molecular Weight: | 195.57 |
Molecular Formula: | C7H5ClF3N |
Canonical SMILES: | C1=CC(=NC=C1C(F)(F)F)CCl |
InChI: | InChI=1S/C7H5ClF3N/c8-3-6-2-1-5(4-12-6)7(9,10)11/h1-2,4H,3H2 |
InChI Key: | XOVKMILMYFEUMK-UHFFFAOYSA-N |
Boiling Point: | 198.1 °C at 760 mmHg |
Density: | 1.359 g/cm3 |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 2.83920 |
Publication Number | Title | Priority Date |
WO-2020243423-A1 | Tead inhibitors and uses thereof | 20190531 |
AU-2018216040-A1 | OGA inhibitor compounds | 20170206 |
CA-3045816-A1 | Oga inhibitor compounds | 20170206 |
CN-110267961-A | OGA inhibitor compound | 20170206 |
EP-3577121-A1 | Oga inhibitor compounds | 20170206 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.0062613 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.0062613 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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