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2,4-Di-tert-amylphenol

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2,4-Di-tert-amylphenol Basic information

Product Name:
2,4-Di-tert-amylphenol
Synonyms:
  • 2,4-bis(1,1-dimethylpropyl)-pheno
  • 2,4-di-tert-pentyl-pheno
  • 2,4-di-tert-Pentylphenyl
  • Di-tert-amylphenol
  • Phenol, 2,4-bis(1,1-dimethylpropyl)-
  • Phenol, 2,4-di-tert-pentyl-
  • 2,4-Di-tert-amylphenol
  • Phenol,2,4-bis(1,1-dimethylpropyl
CAS:
120-95-6
MF:
C16H26O
MW:
234.38
EINECS:
204-439-0
Product Categories:
  • Building Blocks
  • C9 to C20+
  • Chemical Synthesis
  • Organic Building Blocks
  • Oxygen Compounds
  • Organic Building Blocks
  • Oxygen Compounds
  • Phenols
  • Industrial/Fine Chemicals
Mol File:
120-95-6.mol
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2,4-Di-tert-amylphenol Chemical Properties

Melting point:
25 °C (lit.)
Boiling point:
169-170 °C/22 mmHg (lit.)
Density 
0.930 g/mL at 25 °C (lit.)
refractive index 
1.506-1.508
Flash point:
>230 °F
storage temp. 
2-8°C
form 
powder to lump to clear liquid
pka
11.00±0.31(Predicted)
color 
White or Colorless to Almost white or Almost colorless
Water Solubility 
3mg/L at 21℃
InChI
InChI=1S/C16H26O/c1-7-15(3,4)12-9-10-14(17)13(11-12)16(5,6)8-2/h9-11,17H,7-8H2,1-6H3
InChIKey
WMVJWKURWRGJCI-UHFFFAOYSA-N
SMILES
C1(O)=CC=C(C(C)(C)CC)C=C1C(C)(C)CC
LogP
6.3 at 22℃
CAS DataBase Reference
120-95-6(CAS DataBase Reference)
NIST Chemistry Reference
2,4-Di-tert-amyl phenol(120-95-6)
EPA Substance Registry System
2,4-Di-tert-amylphenol (120-95-6)
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Safety Information

Hazard Codes 
Xn
Risk Statements 
22-36-36/38
Safety Statements 
26-37/39
RIDADR 
3077
WGK Germany 
2
RTECS 
SL3500000
HazardClass 
9
PackingGroup 
III
HS Code 
29071990
Hazardous Substances Data
120-95-6(Hazardous Substances Data)

MSDS

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2,4-Di-tert-amylphenol Usage And Synthesis

Chemical Properties

clear yellow liquid after melting

Uses

UV Stabilizer Intermediate, Photographic Developers, Specialty Surfactants, Fuel Additive Intermediate

Uses

2,4-Di-tert-amylphenol is a phenolic compound, used for the laccase induced coupling reactions. It may be used in the synthesis of Cu-phthalocyanine-C60.

General Description

The standard molar enthalpies of sublimation (or vaporization) of 2,4-di-tert-amylphenol have been evaluated. Preparation of 2,4-di-tert-amylphenol, via catalytic alkylation of phenol with trimethylethylene, is reported.

Safety Profile

Poison by ingestion. An eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also PHENOL.

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