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1206969-75-6 | 3-Oxo-3-(6'-methoxylcarbonylpyridin-2-yl)propanenitrile
CAS No: 1206969-75-6 Catalog No: AG00HFME MDL No:
Product Description
Catalog Number:
AG00HFME
Chemical Name:
3-Oxo-3-(6'-methoxylcarbonylpyridin-2-yl)propanenitrile
CAS Number:
1206969-75-6
IUPAC Name:
methyl 6-(2-cyanoacetyl)pyridine-2-carboxylate
InChI:
InChI=1S/C10H8N2O3/c1-15-10(14)8-4-2-3-7(12-8)9(13)5-6-11/h2-4H,5H2,1H3
InChI Key:
MKVNIIBUDQRNHR-UHFFFAOYSA-N
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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