| CAS Number | 2096329-54-1 |
| Catalog Number | AG01EHJQ |
| Chemical Name | 6-Butoxy-2-fluoropyridine-3-boronic acid |
| IUPAC Name | (6-butoxy-2-fluoropyridin-3-yl)boronic acid |
| InChI | InChI=1S/C9H13BFNO3/c1-2-3-6-15-8-5-4-7(10(13)14)9(11)12-8/h4-5,13-14H,2-3,6H2,1H3 |
| InChI Key | ASQMUDBGOSFYAL-UHFFFAOYSA-N |
| MDL Number | MFCD18434412 |
| Molecular Formula | C9H13BFNO3 |
| Molecular Weight | 213.0138 |
| SMILES | CCCCOc1ccc(c(n1)F)B(O)O |
| Synonyms | 6-BUTOXY-2-FLUOROPYRIDINE-3-BORONIC ACID,
2096329-54-1,
(6-butoxy-2-fluoropyridin-3-yl)boronic acid,
MFCD18434412,
ZINC169934446,
Y2865,
A-3488,
C9H13BFNO3,
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| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.097g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.015g/mol |
| Monoisotopic Mass | 213.097g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 62.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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