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Home > Fluorides > 201930-83-8
201930-83-8 | Pentanoic acid, 5,5,5-trifluoro-2-oxo-4-(trifluoromethyl)-, ethyl ester
CAS No: 201930-83-8 Catalog No: AG0027X8 MDL No:
Product Description
Catalog Number:
AG0027X8
Chemical Name:
Pentanoic acid, 5,5,5-trifluoro-2-oxo-4-(trifluoromethyl)-, ethyl ester
CAS Number:
201930-83-8
Molecular Formula:
C8H8F6O3
Molecular Weight:
266.1377
IUPAC Name:
ethyl 5,5,5-trifluoro-2-oxo-4-(trifluoromethyl)pentanoate
InChI:
InChI=1S/C8H8F6O3/c1-2-17-6(16)4(15)3-5(7(9,10)11)8(12,13)14/h5H,2-3H2,1H3
InChI Key:
MGYLTMZNOWUGSI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)CC(C(F)(F)F)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:
266.038g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.139g/mol
Monoisotopic Mass:
266.038g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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