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1443354-08-2 | Ethyl 3-(2,3,4-trifluoro-phenoxy)propanoate
CAS No: 1443354-08-2 Catalog No: AG01FB20 MDL No:
Product Description
Catalog Number:
AG01FB20
Chemical Name:
Ethyl 3-(2,3,4-trifluoro-phenoxy)propanoate
CAS Number:
1443354-08-2
Molecular Formula:
C11H11F3O3
Molecular Weight:
248.1984
IUPAC Name:
ethyl 3-(2,3,4-trifluorophenoxy)propanoate
InChI:
InChI=1S/C11H11F3O3/c1-2-16-9(15)5-6-17-8-4-3-7(12)10(13)11(8)14/h3-4H,2,5-6H2,1H3
InChI Key:
FXJQNJCYHDUZPK-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCOc1ccc(c(c1F)F)F
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.066g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.201g/mol
Monoisotopic Mass:
248.066g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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