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273015

Sigma-Aldrich

3,5-Di-tert-butyltoluene

95%

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Linear Formula:
CH3C6H3[C(CH3)3]2
CAS Number:
Molecular Weight:
204.35
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

95%

form

liquid

refractive index

n20/D 1.49 (lit.)

bp

244 °C (lit.)

mp

31-32 °C (lit.)

density

0.86 g/mL at 25 °C (lit.)

SMILES string

Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C

InChI

1S/C15H24/c1-11-8-12(14(2,3)4)10-13(9-11)15(5,6)7/h8-10H,1-7H3

InChI key

WIXDSJRJFDWTNY-UHFFFAOYSA-N

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This Item
B102628294764O6000
4-tert-Butyltoluene 95%

Sigma-Aldrich

B102628

4-tert-Butyltoluene

tert-Octylamine 95%

Sigma-Aldrich

O6000

tert-Octylamine

form

liquid

form

liquid

form

-

form

-

refractive index

n20/D 1.49 (lit.)

refractive index

n20/D 1.492 (lit.)

refractive index

n20/D 1.4 (lit.)

refractive index

n20/D 1.424 (lit.)

bp

244 °C (lit.)

bp

191 °C (lit.)

bp

81-83 °C (lit.)

bp

137-143 °C (lit.)

mp

31-32 °C (lit.)

mp

-

mp

-

mp

-

density

0.86 g/mL at 25 °C (lit.)

density

0.858 g/mL at 25 °C (lit.)

density

0.701 g/mL at 25 °C (lit.)

density

0.805 g/mL at 25 °C (lit.)

Application

3,5-Di-tert-butyltoluene was used in the synthesis of 3,5-di-tert-butyl(bromomethyl)benzene. It was also used in the synthesis of di-tert-butylbenzoic acid.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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THE SYNTHESIS AND SUBSTITUTION REACTIONS OF 3, 5-DI-tert-BUTYLPHENOL.
Elder JW, et al.
Canadian Journal of Chemistry, 41(7), 1653-1656 (1963)
A new synthetic route to donor-acceptor porphyrins.
Plater MJ, et al.
Tetrahedron, 58(12), 2405-2413 (2002)

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