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88350-04-3 | Acetic acid, (8-quinolinyloxy)-, octyl ester
CAS No: 88350-04-3 Catalog No: AG0045YZ MDL No:
Product Description
Catalog Number:
AG0045YZ
Chemical Name:
Acetic acid, (8-quinolinyloxy)-, octyl ester
CAS Number:
88350-04-3
Molecular Formula:
C19H25NO3
Molecular Weight:
315.4067
IUPAC Name:
octyl 2-quinolin-8-yloxyacetate
InChI:
InChI=1S/C19H25NO3/c1-2-3-4-5-6-7-14-22-18(21)15-23-17-12-8-10-16-11-9-13-20-19(16)17/h8-13H,2-7,14-15H2,1H3
InChI Key:
LYRSJMOHRUWWHN-UHFFFAOYSA-N
SMILES:
CCCCCCCCOC(=O)COc1cccc2c1nccc2
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.183g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.413g/mol
Monoisotopic Mass:
315.183g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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