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Home > Pyridines > 1394957-41-5
1394957-41-5 | 3-(propan-2-yloxy)pyridine-2-carbonitrile
CAS No: 1394957-41-5 Catalog No: AG01B591 MDL No:MFCD23113673
Product Description
Catalog Number:
AG01B591
Chemical Name:
3-(propan-2-yloxy)pyridine-2-carbonitrile
CAS Number:
1394957-41-5
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD23113673
IUPAC Name:
3-propan-2-yloxypyridine-2-carbonitrile
InChI:
InChI=1S/C9H10N2O/c1-7(2)12-9-4-3-5-11-8(9)6-10/h3-5,7H,1-2H3
InChI Key:
HXOCATSKQQJRCR-UHFFFAOYSA-N
SMILES:
CC(Oc1cccnc1C#N)C
Properties
Complexity:
182
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:
2
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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