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88349-90-0 | Acetic acid, [(5-chloro-8-quinolinyl)oxy]-, ethyl ester
CAS No: 88349-90-0 Catalog No: AG0045Z3 MDL No:MFCD04275530
Product Description
Catalog Number:
AG0045Z3
Chemical Name:
Acetic acid, [(5-chloro-8-quinolinyl)oxy]-, ethyl ester
CAS Number:
88349-90-0
Molecular Formula:
C13H12ClNO3
Molecular Weight:
265.6923
MDL Number:
MFCD04275530
IUPAC Name:
ethyl 2-(5-chloroquinolin-8-yl)oxyacetate
InChI:
InChI=1S/C13H12ClNO3/c1-2-17-12(16)8-18-11-6-5-10(14)9-4-3-7-15-13(9)11/h3-7H,2,8H2,1H3
InChI Key:
JEMXUSHXYOXNFL-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccc(c2c1nccc2)Cl
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.051g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.693g/mol
Monoisotopic Mass:
265.051g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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