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Home > Boronic Acids > 1704069-31-7
1704069-31-7 | (3-((4-Methylpiperazin-1-yl)sulfonyl)-4-(trifluoroMethoxy)phenyl)boronic acid
CAS No: 1704069-31-7 Catalog No: AG00AR83 MDL No:
Product Description
Catalog Number:
AG00AR83
Chemical Name:
(3-((4-Methylpiperazin-1-yl)sulfonyl)-4-(trifluoroMethoxy)phenyl)boronic acid
CAS Number:
1704069-31-7
IUPAC Name:
[3-(4-methylpiperazin-1-yl)sulfonyl-4-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C12H16BF3N2O5S/c1-17-4-6-18(7-5-17)24(21,22)11-8-9(13(19)20)2-3-10(11)23-12(14,15)16/h2-3,8,19-20H,4-7H2,1H3
InChI Key:
HAFHTCMRFJFMLT-UHFFFAOYSA-N
Properties
Complexity:
520
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.083g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
368.134g/mol
Monoisotopic Mass:
368.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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