| CAS Number | 1256358-98-1 |
| Catalog Number | AG009VGT(AGN-PC-0WABYW) |
| Chemical Name | 6-fluoro-1h-indole-2-boronic acid pinacol ester |
| IUPAC Name | 6-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole |
| InChI | InChI=1S/C14H17BFNO2/c1-13(2)14(3,4)19-15(18-13)12-7-9-5-6-10(16)8-11(9)17-12/h5-8,17H,1-4H3 |
| InChI Key | ZHTMYMRIYSNMNH-UHFFFAOYSA-N |
| MDL Number | MFCD11858391 |
| Molecular Formula | C14H17BFNO2 |
| Molecular Weight | 261.0997 |
| SMILES | CC1(C(C)(C)OB(C2NC3=C(C=CC(=C3)F)C=2)O1)C |
| Synonyms | 1256358-98-1,
6-Fluoro-1h-indole-2-boronic acid pinacol ester,
6-FLUORO-2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-INDOLE,
DTXSID00681934,
MFCD11858391,
ZINC169935429,
FCH2840465,
MB10218,
PC412431,
X0413,
B-2770,
C14H17BFNO2,
ZHTMYMRIYSNMNH-UHFFFAOYSA-N,
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| Complexity | 347 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.103g/mol |
| Monoisotopic Mass | 261.134g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 34.2A^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