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1339681-64-9 | Ethyl 2-(2-fluoro-5-methyl-phenoxy)acetate
CAS No: 1339681-64-9 Catalog No: AG01FB87 MDL No:
Product Description
Catalog Number:
AG01FB87
Chemical Name:
Ethyl 2-(2-fluoro-5-methyl-phenoxy)acetate
CAS Number:
1339681-64-9
Molecular Formula:
C11H13FO3
Molecular Weight:
212.2175
IUPAC Name:
ethyl 2-(2-fluoro-5-methylphenoxy)acetate
InChI:
InChI=1S/C11H13FO3/c1-3-14-11(13)7-15-10-6-8(2)4-5-9(10)12/h4-6H,3,7H2,1-2H3
InChI Key:
DYQOCJIESSBNKS-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1cc(C)ccc1F
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.22g/mol
Monoisotopic Mass:
212.085g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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