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About This Item
Linear Formula:
CH3C6H4MgBr
CAS Number:
Molecular Weight:
195.34
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352103
MDL number:
Product Name
o-Tolylmagnesium bromide solution, 2.0 M in diethyl ether
InChI
1S/C7H7.BrH.Mg/c1-7-5-3-2-4-6-7;;/h2-5H,1H3;1H;/q;;+1/p-1
SMILES string
Cc1ccccc1[Mg]Br
InChI key
DVXDIGKNJYSMFM-UHFFFAOYSA-M
reaction suitability
reaction type: Grignard Reaction
concentration
2.0 M in diethyl ether
density
1.013 g/mL at 25 °C
Quality Level
Related Categories
Application
o-Tolylmagnesium bromide solution can be used to prepare:
- An iridium(I) mesityl complex named Ir(o-tolyl)(CO)(dppe).
- 4-(2-Methylphenyl)-4-oxobutanoic acid, a key intermediate for the synthesis of M1 muscarinic selective agonist AC-42 derivatives.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Dam. 1 - Flam. Liq. 2 - Skin Corr. 1B - STOT SE 3
target_organs
Central nervous system
supp_hazards
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
-40.0 °F
flash_point_c
-40 °C
Regulatory Information
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Synthesis and Reactivity of the Iridium (I) Mesityl Complex Ir (CO)(mes)(dppe). Oxidative Addition and Ligand Activation Reactions
Cleary BP and Eisenberg R
Journal of the American Chemical Society, 117(12), 3510-3521 (1995)
Fluorescent derivatives of AC-42 to probe bitopic orthosteric/allosteric binding mechanisms on muscarinic M1 receptors
Daval SB, et al.
Journal of Medicinal Chemistry, 55(5), 2125-2143 (2012)
Chihiro Tsukano et al.
Chemical & pharmaceutical bulletin, 65(12), 1167-1174 (2017-12-05)
Tetrahydrobiphenylene consists of cyclobutene fused with benzene and cyclohexene rings. In this paper, a direct method for synthesizing tetrahydrobiphenylenes based on a palladium (Pd)(0)-catalyzed C(sp
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