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Home > Boronic Acids > 1704068-75-6
1704068-75-6 | (3,5-diMethyl-4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid
CAS No: 1704068-75-6 Catalog No: AG00AR9U MDL No:MFCD28384281
Product Description
Catalog Number:
AG00AR9U
Chemical Name:
(3,5-diMethyl-4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid
CAS Number:
1704068-75-6
MDL Number:
MFCD28384281
IUPAC Name:
[3,5-dimethyl-4-(4-methylpiperazin-1-yl)sulfonylphenyl]boronic acid
InChI:
InChI=1S/C13H21BN2O4S/c1-10-8-12(14(17)18)9-11(2)13(10)21(19,20)16-6-4-15(3)5-7-16/h8-9,17-18H,4-7H2,1-3H3
InChI Key:
VQXVEHNNEJBMIP-UHFFFAOYSA-N
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.132g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
312.191g/mol
Monoisotopic Mass:
312.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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