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Home > Nitro Compounds > 838838-15-6

838838-15-6

838838-15-6 | 3,4-dimethyl-5-nitrobenzene-1-sulfonamide

CAS No: 838838-15-6 Catalog No: AG019OUA MDL No:MFCD07687329

Product Description

Catalog Number:
AG019OUA
Chemical Name:
3,4-dimethyl-5-nitrobenzene-1-sulfonamide
CAS Number:
838838-15-6
Molecular Formula:
C8H10N2O4S
Molecular Weight:
230.2410
MDL Number:
MFCD07687329
IUPAC Name:
3,4-dimethyl-5-nitrobenzenesulfonamide
InChI:
InChI=1S/C8H10N2O4S/c1-5-3-7(15(9,13)14)4-8(6(5)2)10(11)12/h3-4H,1-2H3,(H2,9,13,14)
InChI Key:
MXSQHPHMAHPHMF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cc(c1C)C)S(=O)(=O)N

Properties

Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.238g/mol
Monoisotopic Mass:
230.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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