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1099636-05-1 | Ethyl 3-(2,5-dichloro-phenoxy)propanoate
CAS No: 1099636-05-1 Catalog No: AG01FBRX MDL No:
Product Description
Catalog Number:
AG01FBRX
Chemical Name:
Ethyl 3-(2,5-dichloro-phenoxy)propanoate
CAS Number:
1099636-05-1
Molecular Formula:
C11H12Cl2O3
Molecular Weight:
263.1172
IUPAC Name:
ethyl 3-(2,5-dichlorophenoxy)propanoate
InChI:
InChI=1S/C11H12Cl2O3/c1-2-15-11(14)5-6-16-10-7-8(12)3-4-9(10)13/h3-4,7H,2,5-6H2,1H3
InChI Key:
XOTMWARGOXLGOP-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCOc1cc(Cl)ccc1Cl
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.016g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.114g/mol
Monoisotopic Mass:
262.016g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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