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89608-39-9 | Hexane, 6,6-diethoxy-1,1,1,2,2,3,3-heptafluoro-5-iodo-
CAS No: 89608-39-9 Catalog No: AG003YQE MDL No:
Product Description
Catalog Number:
AG003YQE
Chemical Name:
Hexane, 6,6-diethoxy-1,1,1,2,2,3,3-heptafluoro-5-iodo-
CAS Number:
89608-39-9
Molecular Formula:
C10H14F7IO2
Molecular Weight:
426.1103
IUPAC Name:
6,6-diethoxy-1,1,1,2,2,3,3-heptafluoro-5-iodohexane
InChI:
InChI=1S/C10H14F7IO2/c1-3-19-7(20-4-2)6(18)5-8(11,12)9(13,14)10(15,16)17/h6-7H,3-5H2,1-2H3
InChI Key:
AEVPITWGXJDSCN-UHFFFAOYSA-N
SMILES:
CCOC(C(CC(C(C(F)(F)F)(F)F)(F)F)I)OCC
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.993g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
426.113g/mol
Monoisotopic Mass:
425.993g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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