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80982-76-9 | Phosphonic acid, [2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, diethyl ester
CAS No: 80982-76-9 Catalog No: AG0050IX MDL No:
Product Description
Catalog Number:
AG0050IX
Chemical Name:
Phosphonic acid, [2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, diethyl ester
CAS Number:
80982-76-9
Molecular Formula:
C7H11F6O3P
Molecular Weight:
288.1246
IUPAC Name:
2-diethoxyphosphoryl-1,1,1,3,3,3-hexafluoropropane
InChI:
InChI=1S/C7H11F6O3P/c1-3-15-17(14,16-4-2)5(6(8,9)10)7(11,12)13/h5H,3-4H2,1-2H3
InChI Key:
BCUYENLMBTVOQU-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(C(F)(F)F)C(F)(F)F)OCC
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.035g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.126g/mol
Monoisotopic Mass:
288.035g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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