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203255-90-7 | Peroxide, bis[(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)carbonyl]
CAS No: 203255-90-7 Catalog No: AG0028RW MDL No:
Product Description
Catalog Number:
AG0028RW
Chemical Name:
Peroxide, bis[(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)carbonyl]
CAS Number:
203255-90-7
Molecular Formula:
C14F22O4
Molecular Weight:
650.1123
IUPAC Name:
(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexanecarbonyl) 1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexane-1-carboperoxoate
InChI:
InChI=1S/C14F22O4/c15-3(5(17,18)9(25,26)13(33,34)10(27,28)6(3,19)20)1(37)39-40-2(38)4(16)7(21,22)11(29,30)14(35,36)12(31,32)8(4,23)24
InChI Key:
XWIGYEOZHFHUEH-UHFFFAOYSA-N
SMILES:
O=C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)OOC(=O)C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F
Properties
Complexity:
961
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
649.945g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
26
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
650.115g/mol
Monoisotopic Mass:
649.945g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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