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Home > Pyridines > 113614-06-5
113614-06-5 | 3-Pyridinecarbonitrile, 2-(ethenyloxy)-4-(methoxymethyl)-6-methyl-
CAS No: 113614-06-5 Catalog No: AG00095F MDL No:
Product Description
Catalog Number:
AG00095F
Chemical Name:
3-Pyridinecarbonitrile, 2-(ethenyloxy)-4-(methoxymethyl)-6-methyl-
CAS Number:
113614-06-5
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
2-ethenoxy-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
InChI:
InChI=1S/C11H12N2O2/c1-4-15-11-10(6-12)9(7-14-3)5-8(2)13-11/h4-5H,1,7H2,2-3H3
InChI Key:
IBYHIMQMGHLVHC-UHFFFAOYSA-N
SMILES:
COCc1cc(C)nc(c1C#N)OC=C
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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