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372129

Sigma-Aldrich

2,4-Bis(α,α-dimethylbenzyl)phenol

95%

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About This Item

Fórmula linear:
[C6H5C(CH3)2]2C6H3OH
Número CAS:
2772-45-4
Peso molecular:
330.46
Número CE:
220-466-0
Número MDL:
MFCD00191242
Código UNSPSC:
12352100
ID de substância PubChem:
24863020
NACRES:
NA.22

Ensaio

95%

forma

solid

pb

206 °C/15 mmHg (lit.)

pf

63-65 °C (lit.)

cadeia de caracteres SMILES

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

chave InChI

FMUYQRFTLHAARI-UHFFFAOYSA-N

Descrição geral

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.

Aplicação

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).

Pictogramas

Exclamation markEnvironment
GHS07,GHS09

Palavra indicadora

Warning

Frases de perigo

H319,H410

Classificações de perigo

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

Código de classe de armazenamento

11 - Combustible Solids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

Not applicable

Ponto de fulgor (°C)

Not applicable

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Certificados de análise (COA)

Lot/Batch Number
10815TF
00421EU
28903

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Zhuo Wang et al.
Journal of chromatography. A, 1616, 460793-460793 (2019-12-24)
With 4,4'-diaminoterphenyl and phloroglucinol as the monomers, Azo-linked porous organic polymer (PP) was prepared by a green mild azo reaction. Azo-PP is rich in phenolic hydroxyl groups and benzene rings, which can form intermolecular hydrogen bonds with the phenolic hydroxyl
Bryan
Acta crystallographica. Section C, Crystal structure communications, 56 (Pt 8), 1046-1047 (2000-08-16)
The structure of the title compound, 2, 4-bis(1-methyl-1-phenylethyl)phenol, C(24)H(26)O, was found to have a torsion angle of 129.95 (13) degrees for the C-C bond that connects the benzyl carbon to the phenol ring ortho to the OH group. A value
A highly efficient catalyst for the ?living? and ?immortal? polymerization of e-caprolactone and L-lactide.
Liu Y-C, et al.
Macromolecules, 34(18), 6196-6201 (2001)
María J Duart et al.
Journal of medicinal chemistry, 49(12), 3667-3673 (2006-06-09)
Molecular topology was used to achieve a mathematical model capable of classifying compounds according to their antihistaminic activity and low sedative effects. By application of this model of activity to databases containing chemical reagents and drugs exhibiting other pharmacological activity
Alan J Bergmann et al.
Analytical and bioanalytical chemistry, 412(19), 4527-4536 (2020-05-28)
Food contact materials (FCM) may contain complex mixtures of estrogenic chemicals. A yeast estrogen screen performed on high performance thin-layer chromatography plates (planar-YES, P-YES) is promising for analysis of such mixtures, as it could allow for better elucidation of effects

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