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Perfluoro (N-methylpiperidine)

CAT: 0127-PC6123Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0127-PC6123Size:1 Each
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CAS Number
359-71-7
MDL Number
MFCD00042443
Purity
99%
Smiles
FC(F)(F)N1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F

Chemical Information

2,2,3,3,4,4,5,5,6,6-Decafluoro-1-(trifluoromethyl)piperidine
CAS Number359-71-7
PubChem CID2776242
IUPAC Name2,2,3,3,4,4,5,5,6,6-decafluoro-1-(trifluoromethyl)piperidine
Molecular FormulaC6F13N
Molecular Weight333.05
XLogP4.8
Topological Polar Surface Area3.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count14
Rotatable Bond Count0
Heavy Atom Count20
Formal Charge0
Complexity376
SMILES
C1(C(C(N(C(C1(F)F)(F)F)C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C6F13N/c7-1(8)2(9,10)4(13,14)20(6(17,18)19)5(15,16)3(1,11)12
InChIKey
KCOKATNPCXDTEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2,3,3,4,4,5,5,6,6-Decafluoro-1-(trifluoromethyl)piperidine
CAS: 359-71-7
CID: 2776242
Formula: C6F13N
MW: 333.05
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight333.05
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count14
Rotatable Bond Count0
Exact Mass332.9823151
Monoisotopic Mass332.9823151
Topological Polar Surface Area3.2 Ų
Heavy Atom Count20
Formal Charge0
Complexity376
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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