905119
all-cis-Hexafluorocylclohexane
Synonym(s):
all-cis-1,2,3,4,5,6-Hexafluorocyclohexane
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About This Item
Empirical Formula (Hill Notation):
C6H6F6
CAS Number:
Molecular Weight:
192.10
MDL number:
UNSPSC Code:
12352101
NACRES:
NA.22
form
solid
mp
289-290 °C
functional group
fluoro
storage temp.
2-8°C
SMILES string
F[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H]([C@@H]1F)F)F)F)F
InChI key
PQJGSPVYVGXTJW-JMVOWJSSSA-N
Application
The incorporation of fluorine in agrochemical and pharmaceutical compounds is of high interest due to the ability to fine-tune the polarity, pKA-value, conformation and metabolic stability. Derived from a cis-selective hydrogenation developed by Glorius and co-workers, this fluorinated compound displays a diverse utility as a building block for chemical synthesis. All-cis-multifluorinated cyclohexanes are of great interest in material chemistry. All-cis-1,2,3,4,5,6-hexafluorocyclohexane, which has been referred to as “Janus-headed” molecule, is one of the most polar compounds known. Liquid crystalline materials are known applications for all-cis-multifluorinated cyclohexanes.
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Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
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