Perfluoro-1,3-dimethylcyclohexane - CAS 335-27-3
Catalog: |
BB021756 |
Product Name: |
Perfluoro-1,3-dimethylcyclohexane |
CAS: |
335-27-3 |
Synonyms: |
1,1,2,2,3,3,4,5,5,6-decafluoro-4,6-bis(trifluoromethyl)cyclohexane |
IUPAC Name: | 1,1,2,2,3,3,4,5,5,6-decafluoro-4,6-bis(trifluoromethyl)cyclohexane |
Description: | Perfluoro-1,3-dimethylcyclohexane (CAS# 335-27-3) is a useful research chemical. |
Molecular Weight: | 400.06 |
Molecular Formula: | C8F16 |
Canonical SMILES: | C1(C(C(C(C(C1(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F |
InChI: | InChI=1S/C8F16/c9-1(7(19,20)21)3(11,12)2(10,8(22,23)24)5(15,16)6(17,18)4(1,13)14 |
InChI Key: | LOQGSOTUHASIHI-UHFFFAOYSA-N |
Boiling Point: | 101-102 °C |
Melting Point: | -55 °C |
Flash Point: | None |
Purity: | > 80.0 % (GC) |
Density: | 1.828 g/cm3 |
Solubility: | water, 0.004028 mg/L @ 25 °C (est) |
Appearance: | Colorless liquid |
MDL: | MFCD00001469 |
LogP: | 5.08240 |
Refractive Index: | 1.3 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112363640-A | Touch sensing module and method for forming the same | 20201112 |
JP-2020128560-A | Coating composition | 20200603 |
US-2021267871-A1 | Hair cosmetic compositions containing sugar alcohol, saccharide compound, and pectin and methods of use | 20200228 |
WO-2021173399-A1 | Cosmetic compositions containing a sugar alcohol, a saccharide compound and pectin and methods of use | 20200228 |
WO-2021168041-A1 | Method for the in-situ encapsulation and/or insulation of piping | 20200219 |
PMID | Publication Date | Title | Journal |
21928010 | 20120101 | Fluoroponytailed crown ethers and quaternary ammonium salts as solid-liquid phase transfer catalysts in organic synthesis | Topics in current chemistry |
21594285 | 20110801 | Mechanism and dynamics of intramolecular triplet state decay of 1-propyl-4-thiouracil and its α-methyl-substituted derivatives studied in perfluoro-1,3-dimethylcyclohexane | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
18461988 | 20080529 | Solvation of halogens in fluorous phases. Experimental and simulation data for F2, Cl2, and Br2 in several fluorinated liquids | The journal of physical chemistry. B |
15549788 | 20041126 | Synthesis, basicity, and dynamics of a perfluorocyclohexenyl anion | The Journal of organic chemistry |
12017469 | 20020501 | Intra- and intermolecular electronic relaxation of the second excited singlet and the lowest excited triplet states of 1,3-dimethyl-4-thiouracil in solution | Photochemistry and photobiology |
Complexity: | 479 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 399.9744506 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 16 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 399.9744506 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.4 |
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