| CAS Number | 2096997-12-3 |
| Catalog Number | AG01EHNO |
| Chemical Name | Benzyl N-[3-fluoro-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate |
| IUPAC Name | benzyl N-[3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate |
| InChI | InChI=1S/C20H23BFNO4/c1-19(2)20(3,4)27-21(26-19)15-10-16(22)12-17(11-15)23-18(24)25-13-14-8-6-5-7-9-14/h5-12H,13H2,1-4H3,(H,23,24) |
| InChI Key | MGUIBIHKMSUVJX-UHFFFAOYSA-N |
| MDL Number | MFCD18311831 |
| Molecular Formula | C20H23BFNO4 |
| Molecular Weight | 371.2103 |
| SMILES | FC=1C=C(C=C(C1)B1OC(C(O1)(C)C)(C)C)NC(OCC1=CC=CC=C1)=O |
| Synonyms | Benzyl N-[3-fluoro-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate,
2096997-12-3,
Benzyl (3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate,
MFCD22192533,
AKOS027368030,
ZINC169978483,
Y2898,
B-8680,
C20H23BFNO4,
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| Complexity | 508 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 371.17g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 371.215g/mol |
| Monoisotopic Mass | 371.17g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 56.8A^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