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B78106

Sigma-Aldrich

1-Bromopropane

99%

Synonym(s):

Propyl bromide

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About This Item

Linear Formula:
CH3CH2CH2Br
CAS Number:
106-94-5
Molecular Weight:
122.99
Beilstein:
505936
EC Number:
203-445-0
MDL number:
MFCD00000254
UNSPSC Code:
12352100
PubChem Substance ID:
24892019
NACRES:
NA.22

vapor density

4.3 (vs air)

vapor pressure

146 mmHg ( 20 °C)

Assay

99%

form

liquid

autoignition temp.

914 °F

refractive index

n20/D 1.434 (lit.)

bp

71 °C (lit.)

mp

−110 °C (lit.)

density

1.354 g/mL at 25 °C (lit.)

SMILES string

CCCBr

InChI

1S/C3H7Br/c1-2-3-4/h2-3H2,1H3

InChI key

CYNYIHKIEHGYOZ-UHFFFAOYSA-N

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Application

1-Bromopropane is used as a component of various models of binary mixtures, prepared to study their properties such as viscosity and refractive index.
It can be used as an alkylating reagent:
  • For the functionalization of seleno-substituted imidazo[1,2-α]pyridine derivatives.
  • For the synthesis of 1,4-dihydroxy-2-propoxy anthraquinone derivatives.

It can also be used as a reactant:
  • For the synthesis of Berberine-benzimidazole derivatives.
  • For the synthesis of alkyl aryl ketones via carbonylative Barbier-Negishi coupling with aryl iodides.

accessory

Product No.
Description
Pricing

Signal Word

Danger

Hazard Classifications

Aquatic Chronic 3 - Carc. 2 - Eye Irrit. 2 - Flam. Liq. 3 - Ozone 1 - Repr. 1B - Skin Irrit. 2 - STOT RE 2 Inhalation - STOT SE 3

Target Organs

Central nervous system, Liver,Central nervous system, Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

76.1 °F - closed cup

Flash Point(C)

24.5 °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.

EU REACH SVHC Candidate List

CAS No.

EU REACH Annex XVII (Restriction List)

CAS No.

EU REACH Annex XIV (Authorisation List)

CAS No.

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Sahabudeen Sheik Mohideen et al.
Toxicology, 285(1-2), 67-71 (2011-04-30)
1-Bromopropane (1-BP) has been used as an alternative to ozone-depleting solvents. Previous studies showed that 1-BP is neurotoxic in animals and humans. In humans, exposure to 1-BP caused various neurological and neurobehavioral symptoms or signs including depressive or irritated mood.
Viscosity of pure organic liquids and binary liquid mixtures (2009)
Nickel-catalyzed C (sp2)-H selenation of imidazo [1, 2-?] pyridines with arylboronic acids or alkyl reagents using selenium powder.
Zhu J, et al.
Tetrahedron, 74(45), 6569-6576 (2018)
Makoto Samukawa et al.
Archives of internal medicine, 172(16), 1257-1260 (2012-08-16)
Health hazard alerts to 1-bromopropane, an alternative to ozone layer-damaging organic solvents, have been issued by some countries. Herein, we report a new case of 1-bromopropane-induced neurotoxicity. A 43-year-old male industrial worker developed muscle weakness, pain, numbness, and gait disturbance.
Design, synthesis and biological evaluation of berberine-benzimidazole hybrids as new type of potentially DNA-targeting antimicrobial agents.
Jeyakkumar P, et al.
European Journal of Medicinal Chemistry, 122(11), 205-215 (2016)
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