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Home > Nitro Compounds > 1261936-21-3
1261936-21-3 | 3-(2-N,N-Dimethylsulfamoylphenyl)-5-nitrobenzoic acid
CAS No: 1261936-21-3 Catalog No: AG00HMLY MDL No:
Product Description
Catalog Number:
AG00HMLY
Chemical Name:
3-(2-N,N-Dimethylsulfamoylphenyl)-5-nitrobenzoic acid
CAS Number:
1261936-21-3
IUPAC Name:
3-[2-(dimethylsulfamoyl)phenyl]-5-nitrobenzoic acid
InChI:
InChI=1S/C15H14N2O6S/c1-16(2)24(22,23)14-6-4-3-5-13(14)10-7-11(15(18)19)9-12(8-10)17(20)21/h3-9H,1-2H3,(H,18,19)
InChI Key:
QGHGJVLBSICNRB-UHFFFAOYSA-N
Properties
Complexity:
580
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.057g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.345g/mol
Monoisotopic Mass:
350.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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