| CAS Number | 2246886-35-9 |
| Catalog Number | AG01FKZW(AGN-PC-3H4B15) |
| Chemical Name | N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)pentanamide |
| IUPAC Name | N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pentanamide |
| InChI | InChI=1S/C17H26BNO3/c1-6-7-11-15(20)19-14-10-8-9-13(12-14)18-21-16(2,3)17(4,5)22-18/h8-10,12H,6-7,11H2,1-5H3,(H,19,20) |
| InChI Key | ARYPRRVFLGRJOK-UHFFFAOYSA-N |
| MDL Number | MFCD31916478 |
| Molecular Formula | C17H26BNO3 |
| Molecular Weight | 303.2042 |
| SMILES | CCCCC(NC1=CC=CC(B2OC(C)(C)C(C)(C)O2)=C1)=O |
| Synonyms | 2246886-35-9,
N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)pentanamide,
N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pentanamide,
AS-55529,
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| Complexity | 381 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 303.201g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 303.209g/mol |
| Monoisotopic Mass | 303.201g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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