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Home > Nitro Compounds > 111795-99-4
111795-99-4 | 6-Methoxy-3-nitropyridine-2-acetonitrile
CAS No: 111795-99-4 Catalog No: AG003N9L MDL No:
Product Description
Catalog Number:
AG003N9L
Chemical Name:
6-Methoxy-3-nitropyridine-2-acetonitrile
CAS Number:
111795-99-4
IUPAC Name:
2-(6-methoxy-3-nitropyridin-2-yl)acetonitrile
InChI:
InChI=1S/C8H7N3O3/c1-14-8-3-2-7(11(12)13)6(10-8)4-5-9/h2-3H,4H2,1H3
InChI Key:
KOOPAOCWSWOMQI-UHFFFAOYSA-N
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.162g/mol
Monoisotopic Mass:
193.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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