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Home > Nitro Compounds > 131357-58-9
131357-58-9 | [1,2,5]Oxadiazolo[3,4-b]pyrazine, 1,4,5,6-tetrahydro-4-nitroso-
CAS No: 131357-58-9 Catalog No: AG000VZZ MDL No:
Product Description
Catalog Number:
AG000VZZ
Chemical Name:
[1,2,5]Oxadiazolo[3,4-b]pyrazine, 1,4,5,6-tetrahydro-4-nitroso-
CAS Number:
131357-58-9
Molecular Formula:
C4H5N5O2
Molecular Weight:
155.1148
IUPAC Name:
4-nitroso-6,7-dihydro-5H-[1,2,5]oxadiazolo[3,4-b]pyrazine
InChI:
InChI=1S/C4H5N5O2/c10-8-9-2-1-5-3-4(9)7-11-6-3/h1-2H2,(H,5,6)
InChI Key:
MZHOLCAGRVWYDG-UHFFFAOYSA-N
SMILES:
O=NN1CCN=c2c1no[nH]2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.044g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.117g/mol
Monoisotopic Mass:
155.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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