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Chloroperfluorocyclohexane

CAT: 0024-sc-326656ASize: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-326656ASize:5 g
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CAS Number
336-15-2

Chemical Information

Chloroperfluorocyclohexane
CAS Number336-15-2
PubChem CID2736633
IUPAC Name1-chloro-1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexane
Molecular FormulaC6ClF11
Molecular Weight316.50
XLogP3.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count0
Heavy Atom Count18
Formal Charge0
Complexity342
SMILES
C1(C(C(C(C(C1(F)F)(F)F)(F)Cl)(F)F)(F)F)(F)F
InChI
InChI=1S/C6ClF11/c7-1(8)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12
InChIKey
KGZKBHYAEBRMAR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chloroperfluorocyclohexane
CAS: 336-15-2
CID: 2736633
Formula: C6ClF11
MW: 316.50
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.50
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count0
Exact Mass315.9512875
Monoisotopic Mass315.9512875
Topological Polar Surface Area0 Ų
Heavy Atom Count18
Formal Charge0
Complexity342
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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