Quality Segment
assay
97%
refractive index
n20/D 1.446 (lit.)
bp
146 °C (lit.)
density
1.134 g/mL at 25 °C (lit.)
functional group
alkyl halide, bromo
SMILES string
CC(C)CCCBr
InChI
1S/C6H13Br/c1-6(2)4-3-5-7/h6H,3-5H2,1-2H3
InChI key
XZKFBZOAIGFZSU-UHFFFAOYSA-N
General description
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 P′H conformers.
Application
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
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
73.4 °F
flash_point_c
23 °C
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter