2-Chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine N-Oxide - CAS 163119-28-6
Catalog: |
BB062384 |
Product Name: |
2-Chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine N-Oxide |
CAS: |
163119-28-6 |
Synonyms: |
2-Chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine N-Oxide; 2-(chloromethyl)-3-methyl-1-oxido-4-(2,2,2-trifluoroethoxy)pyridin-1-ium; 2-(Chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine 1-oxide; 2-Chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridineN-Oxide; 2-(Chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine1-oxide |
IUPAC Name: | 2-(chloromethyl)-3-methyl-1-oxido-4-(2,2,2-trifluoroethoxy)pyridin-1-ium |
Description: | 2-Chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine N-Oxide (cas# 163119-28-6) is a compound useful in organic synthesis. |
Molecular Weight: | 255.62 |
Molecular Formula: | C9H9ClF3NO2 |
Canonical SMILES: | CC1=C(C=C[N+](=C1CCl)[O-])OCC(F)(F)F |
InChI: | InChI=1S/C9H9ClF3NO2/c1-6-7(4-10)14(15)3-2-8(6)16-5-9(11,12)13/h2-3H,4-5H2,1H3 |
InChI Key: | RHMLJJHQPXWHRI-UHFFFAOYSA-N |
Solubility: | Dimethyl Sulfoxide |
Appearance: | Light Brown Solid |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.0273907 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.0273907 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 34.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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