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494348

Sigma-Aldrich

1-Bromo-4-methylpentane

97%

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About This Item

Fórmula linear:
(CH3)2CH(CH2)3Br
Número CAS:
Peso molecular:
165.07
Número CE:
Número MDL:
Código UNSPSC:
12352100
ID de substância PubChem:
NACRES:
NA.22

Nível de qualidade

Ensaio

97%

índice de refração

n20/D 1.446 (lit.)

p.e.

146 °C (lit.)

densidade

1.134 g/mL at 25 °C (lit.)

grupo funcional

alkyl halide
bromo

cadeia de caracteres SMILES

CC(C)CCCBr

InChI

1S/C6H13Br/c1-6(2)4-3-5-7/h6H,3-5H2,1-2H3

chave InChI

XZKFBZOAIGFZSU-UHFFFAOYSA-N

Categorias relacionadas

Descrição geral

1-Bromo-4-methylpentane can be synthesized by treating 4-methyl-1-pentanol with phosphorous tribromide. The conformational analysis of its liquid-state and solid-state IR and Raman spectra and showed the presence of a mixture of PC,PH, and PH conformers.

Aplicação

1-Bromo-4-methylpentane may be used in the synthesis of:
  • diethyl 2-(4′-methylpentyl)malonate
  • 1,3-bis(4-(isopentyloxy)phenyl)urea
  • 1,3-bis(4-(isopentyloxy)phenyl)thiourea
  • 13-methyl-1-[(tetrahydropyran-2-yl)oxy]tetradec-8-yne
  • 15-methyl-1-[(tetrahydropyran-2-yl)oxy]hexadec-10-yne
  • 3-[2-isohexyloxy-3-(hydroxymethyl]-5-phenyl-2-isohexyloxybenzyl alcohol

Pictogramas

FlameExclamation mark

Palavra indicadora

Warning

Frases de perigo

Classificações de perigo

Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3

Código de classe de armazenamento

3 - Flammable liquids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

73.4 °F

Ponto de fulgor (°C)

23 °C

Equipamento de proteção individual

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


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Vibrational analysis of alkyl bromides: Part III. Branched-chain bromides: 1-bromo-3-methylbutane and 1-bromo-4-methylpentane.
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Journal of Molecular Structure, 42, 71-76 (1977)
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Chemistry and physics of lipids, 145(1), 37-44 (2006-11-28)
The first total syntheses for the (Z)-15-methyl-10-hexadecenoic acid and the (Z)-13-methyl-8-tetradecenoic acid were accomplished in seven steps and in 31-32% overall yields. The (trimethylsilyl)acetylene was the key reagent in both syntheses. It is proposed that the best synthetic strategy towards
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Journal of chemical ecology, 29(10), 2235-2252 (2003-12-20)
Gas chromatography, coupled gas chromatography-mass spectrometry (electron impact mode and chemical ionization with methane as reactant gas), gas chromatography-infrared spectroscopy, and derivatization techniques were used to identity 53 compounds in the interdigital secretion of the red hartebeest, Alcelaphus buselaphus caama.

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