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Home > Fluorides > 1443347-58-7
1443347-58-7 | Ethyl 4-[3-(trifluoromethyl)-phenoxy]butanoate
CAS No: 1443347-58-7 Catalog No: AG01FA4W MDL No:
Product Description
Catalog Number:
AG01FA4W
Chemical Name:
Ethyl 4-[3-(trifluoromethyl)-phenoxy]butanoate
CAS Number:
1443347-58-7
Molecular Formula:
C13H15F3O3
Molecular Weight:
276.2516
IUPAC Name:
ethyl 4-[3-(trifluoromethyl)phenoxy]butanoate
InChI:
InChI=1S/C13H15F3O3/c1-2-18-12(17)7-4-8-19-11-6-3-5-10(9-11)13(14,15)16/h3,5-6,9H,2,4,7-8H2,1H3
InChI Key:
KJGYBVHVUMVBLP-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1cccc(c1)C(F)(F)F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.097g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.255g/mol
Monoisotopic Mass:
276.097g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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