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Home > Boronic Acids > 1158984-95-2
1158984-95-2 | Boron, [N-[(carboxy-κO)methyl]-N-methylglycinato(2-)-κN,κO][1-(phenylsulfonyl)-1H-indol-2-yl]-, (T-4)-
CAS No: 1158984-95-2 Catalog No: AG000H1Y MDL No:
Product Description
Catalog Number:
AG000H1Y
Chemical Name:
Boron, [N-[(carboxy-κO)methyl]-N-methylglycinato(2-)-κN,κO][1-(phenylsulfonyl)-1H-indol-2-yl]-, (T-4)-
CAS Number:
1158984-95-2
IUPAC Name:
2-[1-(benzenesulfonyl)indol-2-yl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
InChI:
InChI=1S/C19H17BN2O6S/c1-21-12-18(23)27-20(28-19(24)13-21)17-11-14-7-5-6-10-16(14)22(17)29(25,26)15-8-3-2-4-9-15/h2-11H,12-13H2,1H3
InChI Key:
MESWPWMZFWLPMN-UHFFFAOYSA-N
Properties
Complexity:
716
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.09g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
412.223g/mol
Monoisotopic Mass:
412.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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