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Home > Fluorides > 163036-61-1
163036-61-1 | Benzene, 1-(1,1,2,2-tetrafluoroethoxy)-4-(1,1,3,3-tetramethylbutyl)-
CAS No: 163036-61-1 Catalog No: AG001TN8 MDL No:
Product Description
Catalog Number:
AG001TN8
Chemical Name:
Benzene, 1-(1,1,2,2-tetrafluoroethoxy)-4-(1,1,3,3-tetramethylbutyl)-
CAS Number:
163036-61-1
Molecular Formula:
C16H22F4O
Molecular Weight:
306.3389
IUPAC Name:
1-(1,1,2,2-tetrafluoroethoxy)-4-(2,4,4-trimethylpentan-2-yl)benzene
InChI:
InChI=1S/C16H22F4O/c1-14(2,3)10-15(4,5)11-6-8-12(9-7-11)21-16(19,20)13(17)18/h6-9,13H,10H2,1-5H3
InChI Key:
AYAUOMXPHJVCLG-UHFFFAOYSA-N
SMILES:
FC(C(Oc1ccc(cc1)C(CC(C)(C)C)(C)C)(F)F)F
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.161g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.345g/mol
Monoisotopic Mass:
306.161g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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