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1273577-24-4 | 4-Isoxazolecarboxamide, 5-amino-, sulfate (1:1)
CAS No: 1273577-24-4 Catalog No: AG000WYE MDL No:MFCD16495885
Product Description
Catalog Number:
AG000WYE
Chemical Name:
4-Isoxazolecarboxamide, 5-amino-, sulfate (1:1)
CAS Number:
1273577-24-4
Molecular Formula:
C4H7N3O6S
Molecular Weight:
225.1799
MDL Number:
MFCD16495885
IUPAC Name:
5-amino-1,2-oxazole-4-carboxamide;sulfuric acid
InChI:
InChI=1S/C4H5N3O2.H2O4S/c5-3(8)2-1-7-9-4(2)6;1-5(2,3)4/h1H,6H2,(H2,5,8);(H2,1,2,3,4)
InChI Key:
IZAWQSSFWTZPAZ-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.NC(=O)c1cnoc1N
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.006g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
225.175g/mol
Monoisotopic Mass:
225.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
178A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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