| CAS Number | 2096331-54-1 |
| Catalog Number | AG01EHKP |
| Chemical Name | 2,4-Difluoro-5-isobutoxyphenylboronic acid |
| IUPAC Name | [2,4-difluoro-5-(3-methylbutoxy)phenyl]boronic acid |
| InChI | InChI=1S/C11H15BF2O3/c1-7(2)3-4-17-11-5-8(12(15)16)9(13)6-10(11)14/h5-7,15-16H,3-4H2,1-2H3 |
| InChI Key | DZLCKYNMTVATGP-UHFFFAOYSA-N |
| MDL Number | MFCD23381443 |
| Molecular Formula | C11H15BF2O3 |
| Molecular Weight | 244.0428 |
| SMILES | OB(c1cc(OCCC(C)C)c(cc1F)F)O |
| Synonyms | 2096331-54-1,
KM3689,
MFCD21609511,
ZINC169964647,
2,4-DIFLUORO-5-(3-METHYLBUTOXY)PHENYLBORONIC ACID,
2,4-Difluoro-5-isobutoxyphenylboronic acid,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.045g/mol |
| Monoisotopic Mass | 244.108g/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