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About This Item
Linear Formula:
(CH3)2CHCH2CH2Br
CAS Number:
Molecular Weight:
151.04
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-522-9
Beilstein/REAXYS Number:
773652
MDL number:
Assay:
96%
Form:
liquid
Quality Segment
assay
96%
form
liquid
refractive index
n20/D 1.4409 (lit.)
bp
120-121 °C (lit.)
mp
−112 °C (lit.)
solubility
H2O: slightly soluble at 16.5 °C (0.02g/100ml), alcohol: miscible, diethyl ether: miscible
density
1.261 g/mL at 25 °C (lit.)
functional group
alkyl halide, bromo
storage temp.
2-8°C
SMILES string
CC(C)CCBr
InChI
1S/C5H11Br/c1-5(2)3-4-6/h5H,3-4H2,1-2H3
InChI key
YXZFFTJAHVMMLF-UHFFFAOYSA-N
General description
1-Bromo-3-methylbutane is a low toxic bromosolvent.
Application
1-Bromo-3-methylbutane was used in the synthesis of 1-(3-methylbutyl)pyrrole. It was used in the production of pentyl peroxy radical by direct photolysis production method. It was also used as extraction solvent for determination of polycyclic aromatic hydrocarbons in water samples using liquid-liquid microextraction combined with gas chromatography-mass spectrometry.
signalword
Danger
hcodes
Hazard Classifications
Aquatic Chronic 2 - Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
71.6 °F - closed cup
flash_point_c
22 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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