| CAS Number | 871125-94-9 |
| Catalog Number | AG008FFA(AGN-PC-0AC0ZE) |
| Chemical Name | 3-Butoxy-2-fluorophenylboronic acid |
| IUPAC Name | (3-butoxy-2-fluorophenyl)boronic acid |
| InChI | InChI=1S/C10H14BFO3/c1-2-3-7-15-9-6-4-5-8(10(9)12)11(13)14/h4-6,13-14H,2-3,7H2,1H3 |
| InChI Key | WNJLIXXAMYHSLC-UHFFFAOYSA-N |
| MDL Number | MFCD19237182 |
| Molecular Formula | C10H14BFO3 |
| Molecular Weight | 212.0258 |
| SMILES | FC1=C(C=CC=C1B(O)O)OCCCC |
| Synonyms | (3-Butoxy-2-fluorophenyl)boronic acid,
871125-94-9,
3-Butoxy-2-fluorophenylboronic acid,
ACMC-209qez,
CTK8B2516,
DTXSID40716592,
ANW-38505,
MFCD19237182,
AKOS015893178,
ZINC169746556,
PC412268,
AX8231046,
TC-127250,
ST24020372,
V8306,
B-8320,
I04-2259,
C10H14BFO3,
(3-Butoxy-2-fluorophenyl)boronicacid,
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| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.102g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.027g/mol |
| Monoisotopic Mass | 212.102g/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
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Certificate of Analysis
Lot Number