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1153000-35-1 | 6-phenoxy-2-propyl-1,4-dihydroquinolin-4-one
CAS No: 1153000-35-1 Catalog No: AG01A1XG MDL No:MFCD13762637
Product Description
Catalog Number:
AG01A1XG
Chemical Name:
6-phenoxy-2-propyl-1,4-dihydroquinolin-4-one
CAS Number:
1153000-35-1
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
MDL Number:
MFCD13762637
IUPAC Name:
6-phenoxy-2-propyl-1H-quinolin-4-one
InChI:
InChI=1S/C18H17NO2/c1-2-6-13-11-18(20)16-12-15(9-10-17(16)19-13)21-14-7-4-3-5-8-14/h3-5,7-12H,2,6H2,1H3,(H,19,20)
InChI Key:
ZSNFTBBLVPRSRI-UHFFFAOYSA-N
SMILES:
CCCc1cc(=O)c2c([nH]1)ccc(c2)Oc1ccccc1
Properties
Complexity:
398
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:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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