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124095

Sigma-Aldrich

1-Bromo-3-methylbutane

96%

Synonym(s):

Isoamyl bromide, Isopentyl bromide

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About This Item

Linear Formula:
(CH3)2CHCH2CH2Br
CAS Number:
107-82-4
Molecular Weight:
151.04
Beilstein:
773652
EC Number:
203-522-9
MDL number:
MFCD00000253
UNSPSC Code:
12352100
PubChem Substance ID:
24847596
NACRES:
NA.22

Quality Level

200

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

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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.

Signal Word

Danger

Hazard Statements

H225,H315,H319,H335,H411

Hazard Classifications

Aquatic Chronic 2 - Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

71.6 °F - closed cup

Flash Point(C)

22 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

124095-500G:
124095-5G:
124095-VAR:
124095-100G:
124095-BULK:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCW5606
MKCV9014
MKCV8997
MKCR3859
MKCQ4445

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The journal of physical chemistry. A, 112(7), 1445-1456 (2008-01-24)
Cavity ringdown spectra of the A-X electronic transition of all eight isomers of the pentyl peroxy radical are reported. Using the corresponding assignments from previously studied smaller alkyl peroxy radicals, assignments of origin bands are made for the pentyl peroxy
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