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Home > Nitro Compounds > 738531-66-3
738531-66-3 | 4-Isoxazolecarboxamide,5-methyl-N-(5-nitro-2-thiazolyl)-(9CI)
CAS No: 738531-66-3 Catalog No: AG00FTG6 MDL No:
Product Description
Catalog Number:
AG00FTG6
Chemical Name:
4-Isoxazolecarboxamide,5-methyl-N-(5-nitro-2-thiazolyl)-(9CI)
CAS Number:
738531-66-3
IUPAC Name:
5-methyl-N-(5-nitro-1,3-thiazol-2-yl)-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C8H6N4O4S/c1-4-5(2-10-16-4)7(13)11-8-9-3-6(17-8)12(14)15/h2-3H,1H3,(H,9,11,13)
InChI Key:
JXUUSXUIHFMJGL-UHFFFAOYSA-N
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.011g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.22g/mol
Monoisotopic Mass:
254.011g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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