| CAS Number | 2096331-43-8 |
| Catalog Number | AG01EHLR |
| Chemical Name | 3,5-Difluoro-4-propoxyphenylboronic acid |
| IUPAC Name | (3,5-difluoro-4-propoxyphenyl)boronic acid |
| InChI | InChI=1S/C9H11BF2O3/c1-2-3-15-9-7(11)4-6(10(13)14)5-8(9)12/h4-5,13-14H,2-3H2,1H3 |
| InChI Key | NGMFHAGRFNZKKZ-UHFFFAOYSA-N |
| MDL Number | MFCD20231441 |
| Molecular Formula | C9H11BF2O3 |
| Molecular Weight | 215.9896 |
| SMILES | c1(c(c(cc(c1)B(O)O)F)OCCC)F |
| Synonyms | 3,5-Difluoro-4-propoxyphenylboronic acid,
2096331-43-8,
(3,5-difluoro-4-propoxyphenyl)boronic acid,
MFCD20231441,
ZINC169955275,
Y2444,
B-9294,
C9H11BF2O3,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.991g/mol |
| Monoisotopic Mass | 216.077g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number