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Home > Nitro Compounds > 1349719-05-6
1349719-05-6 | 5-Nitro-2-(oxetan-3yloxy)pyridine
CAS No: 1349719-05-6 Catalog No: AG01FEEA MDL No:
Product Description
Catalog Number:
AG01FEEA
Chemical Name:
5-Nitro-2-(oxetan-3yloxy)pyridine
CAS Number:
1349719-05-6
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
IUPAC Name:
5-nitro-2-(oxetan-3-yloxy)pyridine
InChI:
InChI=1S/C8H8N2O4/c11-10(12)6-1-2-8(9-3-6)14-7-4-13-5-7/h1-3,7H,4-5H2
InChI Key:
NFGISEIUOFRCIZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(nc1)OC1COC1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.162g/mol
Monoisotopic Mass:
196.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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