| CAS Number | 838901-79-4 |
| Catalog Number | AG019K5F |
| Chemical Name | N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine |
| IUPAC Name | N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine |
| InChI | InChI=1S/C9H11F3N2O/c1-15-5-4-13-8-3-2-7(6-14-8)9(10,11)12/h2-3,6H,4-5H2,1H3,(H,13,14) |
| InChI Key | ARTVNXIPAGVLJJ-UHFFFAOYSA-N |
| MDL Number | MFCD06634935 |
| Molecular Formula | C9H11F3N2O |
| Molecular Weight | 220.1916 |
| SMILES | COCCNC1=NC=C(C(F)(F)F)C=C1 |
| Synonyms | N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine,
838901-79-4,
AC1MGRT6,
AC1Q4G5K,
CTK7B3529,
ZINC20268638,
AKOS001175953,
MCULE-7575184993,
NE13289,
EN300-25594,
N-(2-methoxyethyl)-5-(trifluoromethyl)pyridin-2-amine, AldrichCPR,
CID2990685,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.195g/mol |
| Monoisotopic Mass | 220.082g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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