| CAS Number | 2096333-61-6 |
| Catalog Number | AG01EHLS |
| Chemical Name | 2,4-Difluoro-5-methyl-3-propoxyphenylboronic acid |
| IUPAC Name | (2,4-difluoro-5-methyl-3-propoxyphenyl)boronic acid |
| InChI | InChI=1S/C10H13BF2O3/c1-3-4-16-10-8(12)6(2)5-7(9(10)13)11(14)15/h5,14-15H,3-4H2,1-2H3 |
| InChI Key | QUDWBJCLUWCROZ-UHFFFAOYSA-N |
| MDL Number | MFCD19237184 |
| Molecular Formula | C10H13BF2O3 |
| Molecular Weight | 230.0162 |
| SMILES | CCCOc1c(F)c(C)cc(c1F)B(O)O |
| Synonyms | 2,4-Difluoro-5-methyl-3-propoxyphenylboronic acid,
2096333-61-6,
(2,4-difluoro-5-methyl-3-propoxyphenyl)boronic acid,
MFCD19237184,
AKOS027373806,
ZINC169951706,
Y2228,
A-2849,
C10H13BF2O3,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.018g/mol |
| Monoisotopic Mass | 230.093g/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