| CAS Number | 31181-85-8 |
| Catalog Number | AG01B841(AGN-PC-02L4FZ) |
| Chemical Name | [5-(Trifluoromethoxy)pyridin-2-yl]methanol |
| IUPAC Name | [5-(trifluoromethoxy)pyridin-2-yl]methanol |
| InChI | InChI=1S/C7H6F3NO2/c8-7(9,10)13-6-2-1-5(4-12)11-3-6/h1-3,12H,4H2 |
| InChI Key | OALSPSYYLWXNHE-UHFFFAOYSA-N |
| MDL Number | MFCD22552062 |
| Molecular Formula | C7H6F3NO2 |
| Molecular Weight | 193.1232 |
| SMILES | FC(OC=1C=CC(=NC1)CO)(F)F |
| Synonyms | [5-(trifluoromethoxy)pyridin-2-yl]methanol,
31181-85-8,
(5-trifluoromethoxy-pyridin-2-yl)-methanol,
SCHEMBL10415286,
OALSPSYYLWXNHE-UHFFFAOYSA-N,
5-trifluoromethoxy-2-pyridinemethanol,
ZINC141098058,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.125g/mol |
| Monoisotopic Mass | 193.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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