188735
3,5-Dichlorobenzyl alcohol
98%
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About This Item
Linear Formula:
Cl2C6H3CH2OH
CAS Number:
Molecular Weight:
177.03
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
262-109-1
MDL number:
Assay:
98%
Form:
solid
Quality Level
assay
98%
form
solid
mp
79-82 °C (lit.)
functional group
chloro, hydroxyl
SMILES string
OCc1cc(Cl)cc(Cl)c1
InChI
1S/C7H6Cl2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2
InChI key
VSNNLLQKDRCKCB-UHFFFAOYSA-N
Application
3,5-Dichlorobenzyl alcohol was used in the preparation of 3,5-dichlorophenylacetonitrile via reaction with boiling SOCl2, followed by reaction with NaCN. It was also used in the synthesis of tert-butyl 2-cyano-3-(3,5-dichlorophenyl)-propanoate via Iridium-catalysed alkylation of tert-butyl cyanoacetate.
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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Iridium catalysed alkylation of tert-butyl cyanoacetate with alcohols under solvent free conditions.
Grigg R, et al.
Tetrahedron, 65(4), 849-854 (2009)
Esben R Sørensen et al.
Archiv der Pharmazie, 338(7), 299-304 (2005-07-05)
The HIV-1 inhibitors described in this paper is closely related to 6-(3,5-dimethylbenzyl)-1-(ethoxy methyl)-5-isopropyluracil (GCA-186) an anti-HIV-1 drug that is highly active against both wild type and mutated HIV-1 strains. The two methyl groups on the 6-benzyl moiety have been shown
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 188735-25G | 04061832279176 |
| 188735-5G | 04061832279183 |