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Home > Boronic Acids > 1704073-98-2
1704073-98-2 | (4-chloro-3-(4-Methylpiperazine-1-carbonyl)phenyl)boronic acid
CAS No: 1704073-98-2 Catalog No: AG00ARE3 MDL No:MFCD28384311
Product Description
Catalog Number:
AG00ARE3
Chemical Name:
(4-chloro-3-(4-Methylpiperazine-1-carbonyl)phenyl)boronic acid
CAS Number:
1704073-98-2
MDL Number:
MFCD28384311
IUPAC Name:
[4-chloro-3-(4-methylpiperazine-1-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C12H16BClN2O3/c1-15-4-6-16(7-5-15)12(17)10-8-9(13(18)19)2-3-11(10)14/h2-3,8,18-19H,4-7H2,1H3
InChI Key:
PDDNKGPQOBJEIN-UHFFFAOYSA-N
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.094g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.531g/mol
Monoisotopic Mass:
282.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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