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Home > Boronic Acids > 1704082-06-3
1704082-06-3 | (3-fluoro-4-(3-(4-Methylpiperazin-1-yl)propoxy)phenyl)boronic acid hydrochloride
CAS No: 1704082-06-3 Catalog No: AG00ARAW MDL No:MFCD28400447
Product Description
Catalog Number:
AG00ARAW
Chemical Name:
(3-fluoro-4-(3-(4-Methylpiperazin-1-yl)propoxy)phenyl)boronic acid hydrochloride
CAS Number:
1704082-06-3
MDL Number:
MFCD28400447
IUPAC Name:
[3-fluoro-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]boronic acid;hydrochloride
InChI:
InChI=1S/C14H22BFN2O3.ClH/c1-17-6-8-18(9-7-17)5-2-10-21-14-4-3-12(15(19)20)11-13(14)16;/h3-4,11,19-20H,2,5-10H2,1H3;1H
InChI Key:
BCMRMYOMTFFCBN-UHFFFAOYSA-N
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.147g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
332.607g/mol
Monoisotopic Mass:
332.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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