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825620-18-6

825620-18-6 | 4-Quinolinol, 7-(1-methylethoxy)-2-phenyl-

CAS No: 825620-18-6 Catalog No: AG00540D MDL No:

Product Description

Catalog Number:
AG00540D
Chemical Name:
4-Quinolinol, 7-(1-methylethoxy)-2-phenyl-
CAS Number:
825620-18-6
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
2-phenyl-7-propan-2-yloxy-1H-quinolin-4-one
InChI:
InChI=1S/C18H17NO2/c1-12(2)21-14-8-9-15-17(10-14)19-16(11-18(15)20)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,19,20)
InChI Key:
WWJSSYQFNXTUMI-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc2c(c1)nc(cc2O)c1ccccc1)C

Properties

Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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