| CAS Number | 1227601-53-7 |
| Catalog Number | AG01BATH |
| Chemical Name | 2,5-Difluoro-4-(hydroxymethyl)pyridine |
| IUPAC Name | (2,5-difluoropyridin-4-yl)methanol |
| InChI | InChI=1S/C6H5F2NO/c7-5-2-9-6(8)1-4(5)3-10/h1-2,10H,3H2 |
| InChI Key | UFVITZSNNOQYBF-UHFFFAOYSA-N |
| MDL Number | MFCD12756645 |
| Molecular Formula | C6H5F2NO |
| Molecular Weight | 145.1068 |
| SMILES | C1=C(C(=CN=C1F)F)CO |
| Synonyms | (2,5-difluoropyridin-4-yl)methanol,
1227601-53-7,
SCHEMBL18614801,
2,5-Difluoro-4-pyridinemethanol,
2,5-Difluoropyridine-4-methanol,
ZINC211804566,
2,5-difluoro-4-(hydroxymethyl)pyridine,
|
| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 145.109g/mol |
| Monoisotopic Mass | 145.034g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number