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52334-40-4 | 2-(Oxazolo[4,5-b]pyridine-2-yl)benzonitrile
CAS No: 52334-40-4 Catalog No: AG00E2F6 MDL No:
Product Description
Catalog Number:
AG00E2F6
Chemical Name:
2-(Oxazolo[4,5-b]pyridine-2-yl)benzonitrile
CAS Number:
52334-40-4
IUPAC Name:
2-([1,3]oxazolo[4,5-b]pyridin-2-yl)benzonitrile
InChI:
InChI=1S/C13H7N3O/c14-8-9-4-1-2-5-10(9)13-16-12-11(17-13)6-3-7-15-12/h1-7H
InChI Key:
KKCBDNQVZSPIJD-UHFFFAOYSA-N
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.059g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.219g/mol
Monoisotopic Mass:
221.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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