| CAS Number | 2096333-16-1 |
| Catalog Number | AG01EHG9 |
| Chemical Name | 5-(Cyclopropylmethoxy)-2,4-difluorophenylboronic acid |
| IUPAC Name | [5-(cyclopropylmethoxy)-2,4-difluorophenyl]boronic acid |
| InChI | InChI=1S/C10H11BF2O3/c12-8-4-9(13)10(3-7(8)11(14)15)16-5-6-1-2-6/h3-4,6,14-15H,1-2,5H2 |
| InChI Key | XABLTWFJOUWSRX-UHFFFAOYSA-N |
| MDL Number | MFCD18783138 |
| Molecular Formula | C10H11BF2O3 |
| Molecular Weight | 228.0003 |
| SMILES | OB(c1cc(OCC2CC2)c(cc1F)F)O |
| Synonyms | 5-(CYCLOPROPYLMETHOXY)-2,4-DIFLUOROPHENYLBORONIC ACID,
2096333-16-1,
(5-(Cyclopropylmethoxy)-2,4-difluorophenyl)boronic acid,
C10H11BF2O3,
KM3743,
MFCD18783138,
AKOS027352472,
ZINC169934895,
Y2781,
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| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.002g/mol |
| Monoisotopic Mass | 228.077g/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