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Home > Nitro Compounds > 99768-68-0
99768-68-0 | 2-Furancarboxamide, 5-nitro-N-2-thiazolyl-
CAS No: 99768-68-0 Catalog No: AG003WH2 MDL No:
Product Description
Catalog Number:
AG003WH2
Chemical Name:
2-Furancarboxamide, 5-nitro-N-2-thiazolyl-
CAS Number:
99768-68-0
Molecular Formula:
C8H5N3O4S
Molecular Weight:
239.2080
IUPAC Name:
5-nitro-N-(1,3-thiazol-2-yl)furan-2-carboxamide
InChI:
InChI=1S/C8H5N3O4S/c12-7(10-8-9-3-4-16-8)5-1-2-6(15-5)11(13)14/h1-4H,(H,9,10,12)
InChI Key:
NKZNKSNTMONKKG-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(o1)[N+](=O)[O-])Nc1nccs1
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.205g/mol
Monoisotopic Mass:
239g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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