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Home > Boronic Acids > 1872388-26-5
1872388-26-5 | 4-tert-butyl-N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)benzamide
CAS No: 1872388-26-5 Catalog No: AG01FL7L MDL No:
Product Description
Catalog Number:
AG01FL7L
Chemical Name:
4-tert-butyl-N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)benzamide
CAS Number:
1872388-26-5
Molecular Formula:
C23H30BNO3
Molecular Weight:
379.3002
IUPAC Name:
4-tert-butyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzamide
InChI:
InChI=1S/C23H30BNO3/c1-21(2,3)17-10-8-16(9-11-17)20(26)25-19-14-12-18(13-15-19)24-27-22(4,5)23(6,7)28-24/h8-15H,1-7H3,(H,25,26)
InChI Key:
RJOFUMDOQVNIHQ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.232g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
379.307g/mol
Monoisotopic Mass:
379.232g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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