| CAS Number | 1418128-33-2 |
| Catalog Number | AG01DHOG |
| Chemical Name | 5-Fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline |
| IUPAC Name | 5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline |
| InChI | InChI=1S/C13H19BFNO2/c1-8-10(6-9(15)7-11(8)16)14-17-12(2,3)13(4,5)18-14/h6-7H,16H2,1-5H3 |
| InChI Key | BHHFDPDYGAZFIE-UHFFFAOYSA-N |
| MDL Number | MFCD18383724 |
| Molecular Formula | C13H19BFNO2 |
| Molecular Weight | 251.1049 |
| SMILES | FC=1C=C(C(=C(N)C1)C)B1OC(C(O1)(C)C)(C)C |
| Synonyms | 1418128-33-2,
5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline,
(3-Amino-5-fluoro-2-methylphenyl)boronic acid pinacol ester,
SCHEMBL14645675,
BHHFDPDYGAZFIE-UHFFFAOYSA-N,
MFCD18383724,
AKOS027255756,
ZINC218552824,
AS-55749,
CS-0080188,
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| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.149g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.108g/mol |
| Monoisotopic Mass | 251.149g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.5A^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