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88350-11-2 | Acetic acid, [(5-chloro-8-quinolinyl)oxy]-, 2-chloroethyl ester
CAS No: 88350-11-2 Catalog No: AG00476B MDL No:
Product Description
Catalog Number:
AG00476B
Chemical Name:
Acetic acid, [(5-chloro-8-quinolinyl)oxy]-, 2-chloroethyl ester
CAS Number:
88350-11-2
Molecular Formula:
C13H11Cl2NO3
Molecular Weight:
300.1373
IUPAC Name:
2-chloroethyl 2-(5-chloroquinolin-8-yl)oxyacetate
InChI:
InChI=1S/C13H11Cl2NO3/c14-5-7-18-12(17)8-19-11-4-3-10(15)9-2-1-6-16-13(9)11/h1-4,6H,5,7-8H2
InChI Key:
FAYHWGJYAFCMLV-UHFFFAOYSA-N
SMILES:
ClCCOC(=O)COc1ccc(c2c1nccc2)Cl
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.012g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.135g/mol
Monoisotopic Mass:
299.012g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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