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Home > Nitro Compounds > 36050-10-9
36050-10-9 | 5-methyl-4-nitrothiophene-2-carboxamide
CAS No: 36050-10-9 Catalog No: AG01B6WO MDL No:MFCD01025640
Product Description
Catalog Number:
AG01B6WO
Chemical Name:
5-methyl-4-nitrothiophene-2-carboxamide
CAS Number:
36050-10-9
Molecular Formula:
C6H6N2O3S
Molecular Weight:
186.1884
MDL Number:
MFCD01025640
IUPAC Name:
5-methyl-4-nitrothiophene-2-carboxamide
InChI:
InChI=1S/C6H6N2O3S/c1-3-4(8(10)11)2-5(12-3)6(7)9/h2H,1H3,(H2,7,9)
InChI Key:
DFQLMQGFILOBCQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(sc1C)C(=O)N
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.01g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.185g/mol
Monoisotopic Mass:
186.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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