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Home > Boronic Acids > 1256360-23-2
1256360-23-2 | Benzyl isopropyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
CAS No: 1256360-23-2 Catalog No: AG009BR9 MDL No:MFCD16660306
Product Description
Catalog Number:
AG009BR9
Chemical Name:
Benzyl isopropyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate
CAS Number:
1256360-23-2
Molecular Formula:
C23H30BNO4
Molecular Weight:
395.2996
MDL Number:
MFCD16660306
IUPAC Name:
benzyl N-propan-2-yl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
InChI:
InChI=1S/C23H30BNO4/c1-17(2)25(21(26)27-16-18-10-8-7-9-11-18)20-14-12-19(13-15-20)24-28-22(3,4)23(5,6)29-24/h7-15,17H,16H2,1-6H3
InChI Key:
CKYYIBJOEDMKPO-UHFFFAOYSA-N
SMILES:
CC(N(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C(=O)OCc1ccccc1)C
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.227g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.306g/mol
Monoisotopic Mass:
395.227g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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