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724746-82-1 | Acetic acid, [(8-chloro-5-quinoxalinyl)oxy]-, methyl ester
CAS No: 724746-82-1 Catalog No: AG005HF4 MDL No:
Product Description
Catalog Number:
AG005HF4
Chemical Name:
Acetic acid, [(8-chloro-5-quinoxalinyl)oxy]-, methyl ester
CAS Number:
724746-82-1
Molecular Formula:
C11H9ClN2O3
Molecular Weight:
252.6538
IUPAC Name:
methyl 2-(8-chloroquinoxalin-5-yl)oxyacetate
InChI:
InChI=1S/C11H9ClN2O3/c1-16-9(15)6-17-8-3-2-7(12)10-11(8)14-5-4-13-10/h2-5H,6H2,1H3
InChI Key:
DSLIOOISXCVKML-UHFFFAOYSA-N
SMILES:
COC(=O)COc1ccc(c2c1nccn2)Cl
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.03g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.654g/mol
Monoisotopic Mass:
252.03g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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