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Home > Nitro Compounds > 6299-51-0
6299-51-0 | 3-(4-Nitrophenyl)-1,2,3-oxadiazole-3-ium-5-olate
CAS No: 6299-51-0 Catalog No: AG00F3JS MDL No:
Product Description
Catalog Number:
AG00F3JS
Chemical Name:
3-(4-Nitrophenyl)-1,2,3-oxadiazole-3-ium-5-olate
CAS Number:
6299-51-0
IUPAC Name:
3-(4-nitrophenyl)oxadiazol-3-ium-5-olate
InChI:
InChI=1S/C8H5N3O4/c12-8-5-10(9-15-8)6-1-3-7(4-2-6)11(13)14/h1-5H
InChI Key:
RKAKVBXADCSTLE-UHFFFAOYSA-N
NSC Number:
44694
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.028g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.145g/mol
Monoisotopic Mass:
207.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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