| CAS Number | 1311315-09-9 |
| Catalog Number | AG01AHJE |
| Chemical Name | (3-Bromo-5-fluoropyridin-4-yl)(cyclohexyl)methanol |
| IUPAC Name | (3-bromo-5-fluoropyridin-4-yl)-cyclohexylmethanol |
| InChI | InChI=1S/C12H15BrFNO/c13-9-6-15-7-10(14)11(9)12(16)8-4-2-1-3-5-8/h6-8,12,16H,1-5H2 |
| InChI Key | GNFNLOGQSXGZQQ-UHFFFAOYSA-N |
| MDL Number | MFCD18785493 |
| Molecular Formula | C12H15BrFNO |
| Molecular Weight | 288.1560 |
| SMILES | OC(C1=C(Br)C=NC=C1F)C1CCCCC1 |
| Synonyms | (3-bromo-5-fluoropyridin-4-yl)(cyclohexyl)methanol,
1311315-09-9,
AKOS033199660,
MCULE-2706275624,
NE21720,
EN300-74930,
Z1258992405,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.16g/mol |
| Monoisotopic Mass | 287.032g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
Lot Number