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Perfluoro (N-methylmorpholine)

CAT: 0127-PC6122-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-PC6122-01Size:5 g
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CAS Number
382-28-5
Synonyms
2,2,3,3,5,5,6,6-octafluoro-4- (trifluoromethyl) morpholine
MDL Number
MFCD00042442
Purity
98%
Smiles
FC(F)(F)N1C(F)(F)C(F)(F)OC(F)(F)C1(F)F

Chemical Information

Perfluoro-N-methylmorpholine
CAS Number382-28-5
PubChem CID67839
IUPAC Name2,2,3,3,5,5,6,6-octafluoro-4-(trifluoromethyl)morpholine
Molecular FormulaC5F11NO
Molecular Weight299.04
XLogP4.2
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count0
Heavy Atom Count18
Formal Charge0
Complexity320
SMILES
C1(C(OC(C(N1C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C5F11NO/c6-1(7)3(10,11)18-4(12,13)2(8,9)17(1)5(14,15)16
InChIKey
PQMAKJUXOOVROI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Perfluoro-N-methylmorpholine
CAS: 382-28-5
CID: 67839
Formula: C5F11NO
MW: 299.04
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight299.04
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count0
Exact Mass298.98042341
Monoisotopic Mass298.98042341
Topological Polar Surface Area12.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity320
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