| CAS Number | 2096339-56-7 |
| Catalog Number | AG01EHD8 |
| Chemical Name | 3-(5-Ethyl-1,2,4-oxadiazol-3-yl)phenylboronic acid |
| IUPAC Name | [3-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]boronic acid |
| InChI | InChI=1S/C10H11BN2O3/c1-2-9-12-10(13-16-9)7-4-3-5-8(6-7)11(14)15/h3-6,14-15H,2H2,1H3 |
| InChI Key | PJKLYGGFHUZTEP-UHFFFAOYSA-N |
| MDL Number | MFCD21332939 |
| Molecular Formula | C10H11BN2O3 |
| Molecular Weight | 218.0169 |
| SMILES | CCc1onc(n1)c1cccc(c1)B(O)O |
| Synonyms | 3-(5-Ethyl-1,2,4-oxadiazol-3-yl)phenylboronic acid,
2096339-56-7,
(3-(5-Ethyl-1,2,4-oxadiazol-3-yl)phenyl)boronic acid,
MFCD21332939,
AKOS027374777,
ZINC169964708,
Y2395,
B-9165,
C10H11BN2O3,
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| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.019g/mol |
| Monoisotopic Mass | 218.086g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 79.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number