3-(Perfluoro-n-decyl)-1,2-propenoxide

• Catalog: OFC38565547
• CAS: 38565-54-7
• Category: Fluorinated Cyclic Ethers
• Synonyms: 1H,2H,3H,3H-Perfluoro-1,2-epoxytridecane; 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Henicosafluoroundecyl)oxirane
• Purity: 97%
• MDL Number: MFCD00236086

• IUPAC Name: 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecyl)oxirane
• InChI: InChI=1S/C13H5F21O/c14-4(15,1-3-2-35-3)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)10(26,27)11(28,29)12(30,31)13(32,33)34/h3H,1-2H2
• InChI Key: KVLHRMQNRDJRKW-UHFFFAOYSA-N
• Isomeric SMILES: C1C(O1)CC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• EC Number: 254-007-0

• Molecular Formula: C13H5F21O
• Molecular Weight: 576.14
• Melting Point: 61-62 °C
• Boiling Point: 112 °C (15 mmHg)
• Flash Point: >110 °C
• Density: 1.758 g/cm3
• Refractive Index: 1.325

• XLogP3-AA: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 10
• Exact Mass: 576.0005062 g/mol
• Monoisotopic Mass: 576.0005062 g/mol
• Topological Polar Surface Area: 12.5Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 792