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Home > Fluorides > 1443336-44-4
1443336-44-4 | Ethyl 4-[2-(trifluoromethyl)-phenoxy]butanoate
CAS No: 1443336-44-4 Catalog No: AG01FA4H MDL No:
Product Description
Catalog Number:
AG01FA4H
Chemical Name:
Ethyl 4-[2-(trifluoromethyl)-phenoxy]butanoate
CAS Number:
1443336-44-4
Molecular Formula:
C13H15F3O3
Molecular Weight:
276.2516
IUPAC Name:
ethyl 4-[2-(trifluoromethyl)phenoxy]butanoate
InChI:
InChI=1S/C13H15F3O3/c1-2-18-12(17)8-5-9-19-11-7-4-3-6-10(11)13(14,15)16/h3-4,6-7H,2,5,8-9H2,1H3
InChI Key:
XBWQHOIGKRQHKW-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1ccccc1C(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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