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3761-92-0

Basic Information
CAS No.: 3761-92-0
Name: HEXYLMAGNESIUM BROMIDE
Article Data: 6
Molecular Structure:
Molecular Structure of 3761-92-0 (HEXYLMAGNESIUM BROMIDE)
Formula: C6H13BrMg
Molecular Weight: 189.378
Synonyms: Hexylmagnesiumbromide (6CI);1-Hexylmagnesium bromide;Bromohexylmagnesium;bromo-hexyl-magnesium;
Density: 0.97 g/mL at 20 °C
Flash Point: -40 °C
Appearance: Brown solution
Hazard Symbols: HighlyF+, CorrosiveC
Risk Codes: 12-14-22-34-66-67
Safety: 16-26-36/37/39-43-45-7/8
Transport Information: UN 2924 3/PG 1
PSA: 0.00000
LogP: 3.37990
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Specification

The Magnesium, bromohexyl-, with the CAS registry number 3761-92-0, has the systematic name of bromo-hexyl-magnesium. It is a kind of brown solution, and belongs to the following product categories: Classes of Metal Compounds; Grignard Reagents; Grignard Reagents & Alkyl Metals; Mg (Magnesium) Compounds; Synthetic Organic Chemistry; Typical Metal Compounds; AlkylChemical Synthesis; Grignard Reagents; Organic Bases; Organometallic Reagents; Synthetic Reagents. And the molecular formula of the chemical is C6H13BrMg.

The characteristics of Magnesium, bromohexyl- are as followings: (1)#H bond acceptors: 0; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 5.

Uses of Magnesium, bromohexyl-: It can react with thiophene-3-carbaldehyde to produce 3-(1-hydroxyheptyl)thiophene. This reaction will need menstruum tetrahydrofuran. The reaction time is 1 hour with temperature of 0°C, and the yield is about 85%.      


 
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Br[Mg]CCCCCC
(2)InChI: InChI=1/C6H13.BrH.Mg/c1-3-5-6-4-2;;/h1,3-6H2,2H3;1H;/q;;+1/p-1/rC6H13BrMg/c1-2-3-4-5-6-8-7/h2-6H2,1H3
(3)InChIKey: SFXUWNMDTWQSHE-ANGMJBDNAQ