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Merck
CN

372129

Sigma-Aldrich

2,4-Bis(α,α-dimethylbenzyl)phenol

95%

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About This Item

Linear Formula:
[C6H5C(CH3)2]2C6H3OH
CAS Number:
2772-45-4
Molecular Weight:
330.46
EC Number:
220-466-0
MDL number:
MFCD00191242
UNSPSC Code:
12352100
PubChem Substance ID:
24863020
NACRES:
NA.22

Key Documents

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Assay

95%

form

solid

bp

206 °C/15 mmHg (lit.)

mp

63-65 °C (lit.)

SMILES string

CC(C)(c1ccccc1)c2ccc(O)c(c2)C(C)(C)c3ccccc3

InChI

1S/C24H26O/c1-23(2,18-11-7-5-8-12-18)20-15-16-22(25)21(17-20)24(3,4)19-13-9-6-10-14-19/h5-17,25H,1-4H3

InChI key

FMUYQRFTLHAARI-UHFFFAOYSA-N

General description

2,4-Bis(α,α-dimethylbenzyl)phenol is reported to possess antihistaminic activity. Structure of 2,4-bis(α,α-dimethylbenzyl)phenol is reported to have a torsion angle of 129.95(13)° for the C-C bond that connects the benzyl carbon to the phenol ring ortho to the OH group.

Application

2,4-Bis(α,α-dimethylbenzyl)phenol may be used in the preparation of a novel ligand, 2,2′-methylenebis(4,6-di(1-methyl-1-phenylethyl)phenol) (MMPEP-H2).

Pictograms

Exclamation markEnvironment
GHS07,GHS09

Signal Word

Warning

Hazard Statements

H319,H410

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Eye Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
10815TF
00421EU
28903

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