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53676-89-4 | 2-(6-ethoxypyridin-2-yl)acetonitrile
CAS No: 53676-89-4 Catalog No: AG019YHH MDL No:MFCD18367810
Product Description
Catalog Number:
AG019YHH
Chemical Name:
2-(6-ethoxypyridin-2-yl)acetonitrile
CAS Number:
53676-89-4
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD18367810
IUPAC Name:
2-(6-ethoxypyridin-2-yl)acetonitrile
InChI:
InChI=1S/C9H10N2O/c1-2-12-9-5-3-4-8(11-9)6-7-10/h3-5H,2,6H2,1H3
InChI Key:
ZZNGZJVCDQOCGQ-UHFFFAOYSA-N
SMILES:
CCOc1cccc(n1)CC#N
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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