methyl 6-butyl-4-oxo-7-phenylmethoxy-1H-quinoline-3-carboxylate


Chemical Name: methyl 6-butyl-4-oxo-7-phenylmethoxy-1H-quinoline-3-carboxylate
CAS Number: 13997-19-8
Product Number: AG001BWH(AGN-PC-0JKIS4)
Synonyms:
MDL No:
Molecular Formula: C22H23NO4
Molecular Weight: 365.4223

Identification/Properties


Computed Properties
Molecular Weight:
365.429g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
8
Exact Mass:
365.163g/mol
Monoisotopic Mass:
365.163g/mol
Topological Polar Surface Area:
64.6A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
553
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H413
Precautionary Statements:
P264-P270-P273-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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