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Home > Nitro Compounds > 1211758-67-6
1211758-67-6 | 3-Nitro-2-(tetrahydro-2H-pyran-4-yloxy)pyridine
CAS No: 1211758-67-6 Catalog No: AG01F9QN MDL No:
Product Description
Catalog Number:
AG01F9QN
Chemical Name:
3-Nitro-2-(tetrahydro-2H-pyran-4-yloxy)pyridine
CAS Number:
1211758-67-6
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
IUPAC Name:
3-nitro-2-(oxan-4-yloxy)pyridine
InChI:
InChI=1S/C10H12N2O4/c13-12(14)9-2-1-5-11-10(9)16-8-3-6-15-7-4-8/h1-2,5,8H,3-4,6-7H2
InChI Key:
JRCLEGSGUUSEGZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccnc1OC1CCOCC1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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