| CAS Number | 1229442-51-6 |
| Catalog Number | AG009YGP(AGN-PC-0WCRP9) |
| Chemical Name | 1-(3-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)propyl)pyrrolidine |
| IUPAC Name | 1-[3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]propyl]pyrrolidine |
| InChI | InChI=1S/C19H30BNO3/c1-18(2)19(3,4)24-20(23-18)16-9-7-10-17(15-16)22-14-8-13-21-11-5-6-12-21/h7,9-10,15H,5-6,8,11-14H2,1-4H3 |
| InChI Key | FTSYPIBWYVWQLG-UHFFFAOYSA-N |
| MDL Number | MFCD28384349 |
| Molecular Formula | C19H30BNO3 |
| Molecular Weight | 331.2574 |
| SMILES | CC1(C(C)(C)OB(C2=CC(OCCCN3CCCC3)=CC=C2)O1)C |
| Synonyms | 1-(3-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)propyl)pyrrolidine,
1229442-51-6,
SCHEMBL8443537,
MFCD28384349,
AKOS025286532,
ZINC203674668,
AM86422,
|
| Complexity | 393 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 331.232g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 331.263g/mol |
| Monoisotopic Mass | 331.232g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 30.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number