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| IUPAC Name: | 1-(chloromethyl)-3-methylbenzene |
| Description: | 3-Methylbenzyl chloride (CAS# 620-19-9) is used in the synthetic preparation of myricetin derivatives containing piperazine amide, which have inhibitory effects on hepG2 and SGC7901 - these derivatives may also be used for preparing antitumor agents. |
| Molecular Weight: | 140.61 |
| Molecular Formula: | C8H9Cl |
| Canonical SMILES: | CC1=CC(=CC=C1)CCl |
| InChI: | InChI=1S/C8H9Cl/c1-7-3-2-4-8(5-7)6-9/h2-5H,6H2,1H3 |
| InChI Key: | LZBOHNCMCCSTJX-UHFFFAOYSA-N |
| Boiling Point: | 195-196 ℃ |
| Purity: | 96 % |
| Density: | 1.064 g/cm3 |
| Appearance: | Clear colorless to slightly yellow liquid |
| Storage: | Refrigerator (+4 ℃) |
| LogP: | 2.73380 |
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