| CAS Number | 2096331-85-8 |
| Catalog Number | AG01EHKR |
| Chemical Name | 5-Butoxy-2,4-difluorophenylboronic acid |
| IUPAC Name | (5-butoxy-2,4-difluorophenyl)boronic acid |
| InChI | InChI=1S/C10H13BF2O3/c1-2-3-4-16-10-5-7(11(14)15)8(12)6-9(10)13/h5-6,14-15H,2-4H2,1H3 |
| InChI Key | SVFPYBWECPHPGQ-UHFFFAOYSA-N |
| MDL Number | MFCD18783136 |
| Molecular Formula | C10H13BF2O3 |
| Molecular Weight | 230.0162 |
| SMILES | CCCCOc1cc(B(O)O)c(cc1F)F |
| Synonyms | 5-BUTOXY-2,4-DIFLUOROPHENYLBORONIC ACID,
2096331-85-8,
(5-butoxy-2,4-difluorophenyl)boronic acid,
MFCD18783136,
ZINC169934884,
Y2814,
B-9415,
C10H13BF2O3,
|
| Complexity | 207 |
| 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 | 5 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number