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About This Item
Linear Formula:
HOC6F4CO2H · xH2O
CAS Number:
Molecular Weight:
210.08 (anhydrous basis)
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
Quality Level
assay
96%
mp
104-107 °C (lit.)
functional group
carboxylic acid, fluoro
SMILES string
O.OC(=O)c1c(F)c(F)c(O)c(F)c1F
InChI
1S/C7H2F4O3.H2O/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10;/h12H,(H,13,14);1H2
InChI key
BTXKLSXOHABRQQ-UHFFFAOYSA-N
Application
2,3,5,6-Tetrafluoro-4-hydroxybenzoic acid hydrate may be used in the preparation of new ligand, methyl 2,3,5,6-tetrafluoro-4-oxybenzoate (C8H3F4O3), combining an electron withdrawing group (C6F4) to tune the reactivity with an anchor group (CO2Me) for immobilization on supports.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Latent ruthenium initiators containing fluoro aryloxide ligands.
Yu Z, et al.
Journal of Organometallic Chemistry, 696(8), 1591-1599 (2011)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 363855-5G | 04061831819915 |
