2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-1,10-decanediol

Product Information

Molecular Formula:
C10H6F16O2
Molecular Weight:
462.13
Description
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-1,10-decanediol (CAS# 754-96-1) is a compound useful in organic synthesis.
Synonyms
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecane-1,10-diol
IUPAC Name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecane-1,10-diol
Canonical SMILES
C(C(C(C(C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
InChI
InChI=1S/C10H6F16O2/c11-3(12,1-27)5(15,16)7(19,20)9(23,24)10(25,26)8(21,22)6(17,18)4(13,14)2-28/h27-28H,1-2H2
InChI Key
NSKCTPBWPZPFHW-UHFFFAOYSA-N
Boiling Point
132 °C4 mmHg (lit.)
Melting Point
135-137 °C (lit.)
Flash Point
132°C/4mm
Purity
> 97.0 % (GC)
Density
1.6113 (estimate) g/cm3
Appearance
White to almost white powder to crystal
LogP
4.05340

Safety Information

Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

XLogP3
4.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
18
Rotatable Bond Count
9
Exact Mass
462.0112300 g/mol
Monoisotopic Mass
462.0112300 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
28
Formal Charge
0
Complexity
518
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

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CN-113173868-A Low-surface-energy hydrophobic dental resin and preparation method thereof 2021-04-28
WO-2022049038-A1 A polyurethane composite sheet, a method of making such composite sheet, and use thereof in making a medical implant 2020-09-01
WO-2021239931-A1 Polymer composition and method of making a medical implant 2020-05-29
WO-2021239932-A1 Medical implant for cartilage replacement and method of making such implant 2020-05-29
CN-111484382-A Fluorine-containing polyurethane coated micro/nano aluminum powder composite particle and preparation method thereof 2020-04-10
CN-111484382-B Fluorine-containing polyurethane coated micro/nano aluminum powder composite particle and preparation method thereof 2020-04-10
JP-2021155706-A Contact member, connector, composition, manufacturing method of contact member 2020-03-27
JP-2021155707-A Contact member, connector, composition, manufacturing method of contact member 2020-03-27
JP-6872088-B1 Manufacturing method of contact members, connectors, compositions, contact members 2020-03-27
JP-6872089-B1 Manufacturing method of contact members, connectors, compositions, contact members 2020-03-27

Literatures

PMID Publication Date Title Journal
19817437 2009-11-05 Molecular orientation and multilayer formation in the adsorbed film of 1H,1H,10H,10H-perfluorodecane-1,10-diol at the hexane/water interface; pressure effect on the adsorption of fluoroalkane-diol The journal of physical chemistry. B
19366243 2009-05-07 Molecular orientation and multilayer formation of 1H,1H,8H,8H-perfluorooctane-1,8-diol at the air/water interface The journal of physical chemistry. B
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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