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88350-06-5 | Acetic acid, (8-quinolinyloxy)-, dodecyl ester
CAS No: 88350-06-5 Catalog No: AG00476H MDL No:
Product Description
Catalog Number:
AG00476H
Chemical Name:
Acetic acid, (8-quinolinyloxy)-, dodecyl ester
CAS Number:
88350-06-5
Molecular Formula:
C23H33NO3
Molecular Weight:
371.5130
IUPAC Name:
dodecyl 2-quinolin-8-yloxyacetate
InChI:
InChI=1S/C23H33NO3/c1-2-3-4-5-6-7-8-9-10-11-18-26-22(25)19-27-21-16-12-14-20-15-13-17-24-23(20)21/h12-17H,2-11,18-19H2,1H3
InChI Key:
YAYZDKGVJXZTBT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOC(=O)COc1cccc2c1nccc2
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.246g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
371.521g/mol
Monoisotopic Mass:
371.246g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
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