Quality Level
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
法规信息
危险化学品
此项目有
Vibrational analysis of alkyl bromides: Part III. Branched-chain bromides: 1-bromo-3-methylbutane and 1-bromo-4-methylpentane.
Crowder GA and Jalilian MR.
Journal of Molecular Structure, 42, 71-76 (1977)
Maria E Amato et al.
Molecules (Basel, Switzerland), 15(3), 1442-1452 (2010-03-26)
A novel chiral macrocyclic ligand incorporating a chiral salen moiety into a framework containing two biphenyl units was synthesized. Structural properties and conformational aspects of the free ligand and an UO2 complex were studied by using NMR spectroscopy in solution
E Takano et al.
The Journal of biological chemistry, 275(15), 11010-11016 (2001-02-07)
Early stationary phase culture supernatants of Streptomyces coelicolor A3(2) contained at least four small diffusible signaling molecules that could elicit precocious antibiotic synthesis in the producing strain. The compounds were not detected in exponentially growing cultures. One of these compounds
全球贸易项目编号
| 货号 | GTIN |
|---|---|
| 494348-5G | 04061837073793 |