Home Nitros 2-(5-nitrofuran-2-yl)-1,3,4-oxadiazole

2-(5-nitrofuran-2-yl)-1,3,4-oxadiazole

CAS No.:
89488-64-2
Catalog Number:
AG019UGP
Molecular Formula:
C6H3N3O4
Molecular Weight:
181.1057
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Product Description
Catalog Number:
AG019UGP
Chemical Name:
2-(5-nitrofuran-2-yl)-1,3,4-oxadiazole
CAS Number:
89488-64-2
Molecular Formula:
C6H3N3O4
Molecular Weight:
181.1057
MDL Number:
MFCD09946359
IUPAC Name:
2-(5-nitrofuran-2-yl)-1,3,4-oxadiazole
InChI:
InChI=1S/C6H3N3O4/c10-9(11)5-2-1-4(13-5)6-8-7-3-12-6/h1-3H
InChI Key:
DMBJNWQLOVXFNG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(o1)c1nnco1
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.012g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.107g/mol
Monoisotopic Mass:
181.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
97.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties