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Home > Fluorides > 1192302-05-8
1192302-05-8 | Ethyl 4-(2,3,4-trifluoro-phenoxy)butanoate
CAS No: 1192302-05-8 Catalog No: AG01FB63 MDL No:
Product Description
Catalog Number:
AG01FB63
Chemical Name:
Ethyl 4-(2,3,4-trifluoro-phenoxy)butanoate
CAS Number:
1192302-05-8
Molecular Formula:
C12H13F3O3
Molecular Weight:
262.2250
IUPAC Name:
ethyl 4-(2,3,4-trifluorophenoxy)butanoate
InChI:
InChI=1S/C12H13F3O3/c1-2-17-10(16)4-3-7-18-9-6-5-8(13)11(14)12(9)15/h5-6H,2-4,7H2,1H3
InChI Key:
ZTJSCAAUPLQZLS-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1ccc(c(c1F)F)F
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.082g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.228g/mol
Monoisotopic Mass:
262.082g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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