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| CAS No.: | 185416-17-5 |
|---|---|
| Name: | 3,5-dimethyl-4-methoxyphenylmagnesium bromide |
| Molecular Structure: | |
|
|
|
| Formula: | C9H11BrMgO |
| Molecular Weight: | 239.395 |
| Synonyms: | 3,5-Dimethyl-4-methoxyphenylmagnesium bromide; |
| Density: | 0.949 g/mL at 25 °C(lit.) |
| Boiling Point: | 65 °C(lit.) |
| Flash Point: | -17 °C |
| Solubility: | Reacts with water. |
| Hazard Symbols: |
 F; C
|
| Risk Codes: | 11-14-19-34 |
| Safety: | 16-26-36/37/39-45 |
| Transport Information: | 16-26-36/37/39-45 |
| PSA: | 9.23000 |
| LogP: | -0.76990 |
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Specification
The Magnesium,bromo(4-methoxy-3,5-dimethylphenyl)-, with the CAS registry number of 185416-17-5, is also known as 3,5-Dimethyl-4-methoxyphenylmagnesium bromide. It belongs to the product categories of Aryl; Grignard Reagents; Organometallic Reagents. Its molecular formula is C9H11BrMgO and molecular weight is 239.392. What's more, its systematic name is Bromo-(4-methoxy-3,5-dimethyl-phenyl)magnesium. In addition, it must be stored in airtight containers and placed in a dry, cool place. Meanwhile, keep it away from oxidant.
Physical properties about the Magnesium,bromo(4-methoxy-3,5-dimethylphenyl)- are: (1)#H bond acceptors: 1; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: Å2.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it may cause burns. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. It reacts violently with water. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(cc(C)c1OC)[Mg]Br
(2) InChI: InChI=1/C9H11O.BrH.Mg/c1-7-5-4-6-8(2)9(7)10-3;;/h5-6H,1-3H3;1H;/q;;+1/p-1/rC9H11BrMgO/c1-6-4-8(11-10)5-7(2)9(6)12-3/h4-5H,1-3H3
(3) InChIKey: KIYSUNNVTFBQIT-AXVACWFQAF