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Home > Nitro Compounds > 1935462-38-6
1935462-38-6 | 5-methyl-2-nitrothiophene-3-sulfonamide
CAS No: 1935462-38-6 Catalog No: AG01C1TP MDL No:
Product Description
Catalog Number:
AG01C1TP
Chemical Name:
5-methyl-2-nitrothiophene-3-sulfonamide
CAS Number:
1935462-38-6
Molecular Formula:
C5H6N2O4S2
Molecular Weight:
222.2421
IUPAC Name:
5-methyl-2-nitrothiophene-3-sulfonamide
InChI:
InChI=1S/C5H6N2O4S2/c1-3-2-4(13(6,10)11)5(12-3)7(8)9/h2H,1H3,(H2,6,10,11)
InChI Key:
MDGOVPHJUGNTSK-UHFFFAOYSA-N
SMILES:
Cc1cc(c(s1)[N+](=O)[O-])S(=O)(=O)N
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.977g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.233g/mol
Monoisotopic Mass:
221.977g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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