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60847-65-6 | 3-Cyano-2-ethoxy-4,6-diphenylpyridine
CAS No: 60847-65-6 Catalog No: AG00EG5I MDL No:
Product Description
Catalog Number:
AG00EG5I
Chemical Name:
3-Cyano-2-ethoxy-4,6-diphenylpyridine
CAS Number:
60847-65-6
IUPAC Name:
2-ethoxy-4,6-diphenylpyridine-3-carbonitrile
InChI:
InChI=1S/C20H16N2O/c1-2-23-20-18(14-21)17(15-9-5-3-6-10-15)13-19(22-20)16-11-7-4-8-12-16/h3-13H,2H2,1H3
InChI Key:
LILZXGWRQBRMKC-UHFFFAOYSA-N
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.126g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.361g/mol
Monoisotopic Mass:
300.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| C-H...N and C-H...pi interactions in 2-ethoxy-4,6-diphenylpyridine-3-carbonitrile. | Acta crystallographica. Section C, Crystal structure communications 20021201 |
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