| CAS Number | 914606-94-3 |
| Catalog Number | AG01DX8R |
| Chemical Name | 4-Morpholinesulfonamide, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- |
| IUPAC Name | N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine-4-sulfonamide |
| InChI | InChI=1S/C16H25BN2O5S/c1-15(2)16(3,4)24-17(23-15)13-5-7-14(8-6-13)18-25(20,21)19-9-11-22-12-10-19/h5-8,18H,9-12H2,1-4H3 |
| InChI Key | HTRQAKVQAAGOMU-UHFFFAOYSA-N |
| MDL Number | MFCD31916433 |
| Molecular Formula | C16H25BN2O5S |
| Molecular Weight | 368.2561 |
| SMILES | CC1(C)OB(OC1(C)C)c1ccc(cc1)NS(=O)(=O)N1CCOCC1 |
| Synonyms | 914606-94-3,
SCHEMBL3976377,
AS-55446,
4-Morpholinesulfonamide, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-,
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine-4-sulfonamide,
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| Complexity | 548 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 368.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 368.255g/mol |
| Monoisotopic Mass | 368.158g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 85.5A^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