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Home > Nitro Compounds > 19871-37-5
19871-37-5 | Benzenesulfonamide, 4-methyl-N-(2-methyl-5-nitrophenyl)-
CAS No: 19871-37-5 Catalog No: AG002BPL MDL No:MFCD00115767
Product Description
Catalog Number:
AG002BPL
Chemical Name:
Benzenesulfonamide, 4-methyl-N-(2-methyl-5-nitrophenyl)-
CAS Number:
19871-37-5
Molecular Formula:
C14H14N2O4S
Molecular Weight:
306.3370
MDL Number:
MFCD00115767
IUPAC Name:
4-methyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide
InChI:
InChI=1S/C14H14N2O4S/c1-10-3-7-13(8-4-10)21(19,20)15-14-9-12(16(17)18)6-5-11(14)2/h3-9,15H,1-2H3
InChI Key:
PFHQXNWGHSJUIH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Nc1cc(ccc1C)[N+](=O)[O-]
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.067g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.336g/mol
Monoisotopic Mass:
306.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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