191639
2,4,6-Trimethylbenzyl alcohol
99%
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About This Item
Linear Formula:
(CH3)3C6H2CH2OH
CAS Number:
Molecular Weight:
150.22
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
224-032-1
MDL number:
Assay:
99%
Form:
solid
Product Name
2,4,6-Trimethylbenzyl alcohol, 99%
InChI key
LODDFDHPSIYCTK-UHFFFAOYSA-N
InChI
1S/C10H14O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-5,11H,6H2,1-3H3
SMILES string
Cc1cc(C)c(CO)c(C)c1
assay
99%
form
solid
bp
140 °C/15 mmHg (lit.)
mp
87-89 °C (lit.)
functional group
hydroxyl
Application
2,4,6-Trimethylbenzyl alcohol was used in the synthesis of 3-(2,4,6-trimethylbenzyl)indole.
General description
2,4,6-Trimethylbenzyl alcohol undergoes oxidation in the presence of molecular iodine and potassium carbonate in 2,2,2-trifluoroethanol.
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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H G Shertzer et al.
Archives of toxicology, 70(12), 830-834 (1996-01-01)
Many dietary constituents, such as indole-3-carbinol, are chemoprotective in toxicity and carcinogenicity bioassays. Indole-3-carbinol and related congeners appear to protect partly via radical and electrophile scavenging. To develop better chemoprotective indoles with lower intrinsic toxicity, we performed molecular graphic and
Facile oxidative conversion of alcohols to esters using molecular iodine.
Mori N and Togo H.
Tetrahedron, 61(24), 5915-5925 (2005)
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