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Home > Boronic Acids > 955407-62-2
955407-62-2 | 4-(4-Methylpiperazinocarbonyl)phenylboronic acid, pinacol ester
CAS No: 955407-62-2 Catalog No: AG00IJ78 MDL No:MFCD15142969
Product Description
Catalog Number:
AG00IJ78
Chemical Name:
4-(4-Methylpiperazinocarbonyl)phenylboronic acid, pinacol ester
CAS Number:
955407-62-2
MDL Number:
MFCD15142969
IUPAC Name:
(4-methylpiperazin-1-yl)-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone;hydrochloride
InChI:
InChI=1S/C18H27BN2O3.ClH/c1-17(2)18(3,4)24-19(23-17)15-8-6-14(7-9-15)16(22)21-12-10-20(5)11-13-21;/h6-9H,10-13H2,1-5H3;1H
InChI Key:
KGFACZAHAULJPC-UHFFFAOYSA-N
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.188g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.693g/mol
Monoisotopic Mass:
366.188g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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