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3-tert-Butylphenol

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3-tert-Butylphenol Basic information

Product Name:
3-tert-Butylphenol
Synonyms:
  • 3-TERT-BUTYLPHENOL
  • 3-(1,1-dimethylethyl)-pheno
  • 3-(1,1-dimethylethyl)-Phenol
  • 3-t-Butylphenol
  • Phenol, 3-tert-butyl-
  • PHENOL, 3-(1,1-DIMETHYLETHYL)-
  • M-T-BUTYLPHENOL
  • M-TERT-BUTYLPHENOL
CAS:
585-34-2
MF:
C10H14O
MW:
150.22
EINECS:
209-553-4
Product Categories:
  • Organic Building Blocks
  • Oxygen Compounds
  • Industrial/Fine Chemicals
  • Phenols
Mol File:
585-34-2.mol
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3-tert-Butylphenol Chemical Properties

Melting point:
44-46 °C (lit.)
Boiling point:
125-130 °C/20 mmHg (lit.)
Density 
0.9688 (estimate)
refractive index 
1.5108 (estimate)
Flash point:
228 °F
storage temp. 
Inert atmosphere,Room Temperature
Water Solubility 
Practically insoluble in water
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Crystalline Powder
pka
10.12(at 25℃)
color 
White to almost white
InChIKey
CYEKUDPFXBLGHH-UHFFFAOYSA-N
LogP
3.300
CAS DataBase Reference
585-34-2(CAS DataBase Reference)
NIST Chemistry Reference
Phenol, m-tert-butyl-(585-34-2)
EPA Substance Registry System
m-tert-Butylphenol (585-34-2)
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Safety Information

Hazard Codes 
C
Risk Statements 
34-20/21/22
Safety Statements 
26-27-28-36/37/39-45
RIDADR 
UN 2430 8/PG 3
WGK Germany 
3
TSCA 
Yes
HazardClass 
8
PackingGroup 
III
HS Code 
29071990

MSDS

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3-tert-Butylphenol Usage And Synthesis

Chemical Properties

WHITE TO ALMOST WHITE CRYSTALLINE POWDER

Uses

3-tert-Butylphenol has been used to study the effect of alkyl group on the phenol ring on the estrogenic potency of alkylphenolic compounds in the yeast screen.

Definition

ChEBI: 3-tert-Butylphenol is an alkylbenzene.

Synthesis Reference(s)

Journal of the American Chemical Society, 83, p. 2507, 1961 DOI: 10.1021/ja01472a021

General Description

3-tert-Butylphenol undergoes stereoselective hydrogenation over charcoal-supported rhodium catalyst in supercritical carbon dioxide solvent.

3-tert-Butylphenol Preparation Products And Raw materials

Preparation Products

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