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Home > Boronic Acids > 1704120-84-2
1704120-84-2 | 2-(4-Methylpiperidin-1-yl)-N-(4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetaMide
CAS No: 1704120-84-2 Catalog No: AG00ARKD MDL No:
Product Description
Catalog Number:
AG00ARKD
Chemical Name:
2-(4-Methylpiperidin-1-yl)-N-(4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetaMide
CAS Number:
1704120-84-2
Molecular Formula:
C20H31BN2O3
Molecular Weight:
358.2827
IUPAC Name:
2-(4-methylpiperidin-1-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
InChI:
InChI=1S/C20H31BN2O3/c1-15-10-12-23(13-11-15)14-18(24)22-17-8-6-16(7-9-17)21-25-19(2,3)20(4,5)26-21/h6-9,15H,10-14H2,1-5H3,(H,22,24)
InChI Key:
DFZHWDWJFAUUIZ-UHFFFAOYSA-N
SMILES:
CC1CCN(CC1)CC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.243g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.289g/mol
Monoisotopic Mass:
358.243g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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