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131118-30-4 | 1-Hexanol, 6-chloro-3,3,4,4,5,5,6,6-octafluoro-
CAS No: 131118-30-4 Catalog No: AG000VJE MDL No:
Product Description
Catalog Number:
AG000VJE
Chemical Name:
1-Hexanol, 6-chloro-3,3,4,4,5,5,6,6-octafluoro-
CAS Number:
131118-30-4
Molecular Formula:
C6H5ClF8O
Molecular Weight:
280.5435
IUPAC Name:
6-chloro-3,3,4,4,5,5,6,6-octafluorohexan-1-ol
InChI:
InChI=1S/C6H5ClF8O/c7-6(14,15)5(12,13)4(10,11)3(8,9)1-2-16/h16H,1-2H2
InChI Key:
LOVABCBJRKCHEM-UHFFFAOYSA-N
SMILES:
OCCC(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.99g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.542g/mol
Monoisotopic Mass:
279.99g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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