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114829-05-9

114829-05-9 | Quinoline, 5-(5-phenyl-2-oxazolyl)-

CAS No: 114829-05-9 Catalog No: AG000FAR MDL No:

Product Description

Catalog Number:
AG000FAR
Chemical Name:
Quinoline, 5-(5-phenyl-2-oxazolyl)-
CAS Number:
114829-05-9
Molecular Formula:
C18H12N2O
Molecular Weight:
272.3007
IUPAC Name:
5-phenyl-2-quinolin-5-yl-1,3-oxazole
InChI:
InChI=1S/C18H12N2O/c1-2-6-13(7-3-1)17-12-20-18(21-17)15-8-4-10-16-14(15)9-5-11-19-16/h1-12H
InChI Key:
UKEUSMSKSADSOF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cnc(o1)c1cccc2c1cccn2

Properties

Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.095g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.307g/mol
Monoisotopic Mass:
272.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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