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| IUPAC Name: | 1-tert-butyl-4-(chloromethyl)benzene |
| Description: | 4-tert-Butylbenzyl chloride (CAS# 19692-45-6) is an intermediate used to prepare aryl pyrazole carbohydrazides as potential agents against A549 lung cancer cells. It is also used in the synthesis of (acyloxybenzylpropyl)(hydroxymethoxybenzyl)thiourea derivatives as vanilloid receptor agonists and analgesics. |
| Molecular Weight: | 182.69 |
| Molecular Formula: | C11H15Cl |
| Canonical SMILES: | CC(C)(C)C1=CC=C(C=C1)CCl |
| InChI: | InChI=1S/C11H15Cl/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,8H2,1-3H3 |
| InChI Key: | WAXIFMGAKWIFDQ-UHFFFAOYSA-N |
| Boiling Point: | 98-103 °C (7 mmHg) |
| Purity: | 97 % |
| Density: | 0.945 g/cm3 |
| Appearance: | Clear colorless to slightly yellow liquid |
| MDL: | MFCD00000918 |
| LogP: | 3.72290 |
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1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
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