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Home > Nitro Compounds > 16243-71-3
16243-71-3 | Thiazole, 2-methyl-5-nitro-
CAS No: 16243-71-3 Catalog No: AG001T6F MDL No:
Product Description
Catalog Number:
AG001T6F
Chemical Name:
Thiazole, 2-methyl-5-nitro-
CAS Number:
16243-71-3
Molecular Formula:
C4H4N2O2S
Molecular Weight:
144.1518
IUPAC Name:
2-methyl-5-nitro-1,3-thiazole
InChI:
InChI=1S/C4H4N2O2S/c1-3-5-2-4(9-3)6(7)8/h2H,1H3
InChI Key:
YIFARGVNPMLZTQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(s1)C
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.999g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.148g/mol
Monoisotopic Mass:
143.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Nitroheterocyclic antimicrobial agents. I. Nitrothiazolecarboxaldehyde derivatives. | Journal of medicinal chemistry 19690501 |
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