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| IUPAC Name: | 2-(3-methylpentoxycarbonyl)benzoic acid |
| Description: | Mono(3-methylpentyl) Phthalate, is a phthalate monoester, which can be used as plasticizers (substances added to plastics to increase their flexibility, transparency, durability, and longevity). It has been also shown to have effects on peroxisomal fatty acid b-oxidation in rats. |
| Molecular Weight: | 250.29 |
| Molecular Formula: | C14H18O4 |
| Canonical SMILES: | CCC(C)CCOC(=O)C1=CC=CC=C1C(=O)O |
| InChI: | InChI=1S/C14H18O4/c1-3-10(2)8-9-18-14(17)12-7-5-4-6-11(12)13(15)16/h4-7,10H,3,8-9H2,1-2H3,(H,15,16) |
| InChI Key: | HFVPVWMVRZNFOP-UHFFFAOYSA-N |
| Solubility: | Chloroform (Slightly), Methanol (Slightly) |
| Appearance: | Colourless to Off-White Thick Oil to Solid |
| Storage: | 4°C, Inert atmosphere |
| References: | Peterson, J.C., et al. Int. J. Envrion. Anal. Chem., 18, 237 (1984); Gharagheizi, F., et al. Indust. Engin. Chem. Res., 49, 12685 (2010); Lake, B. G., et al. Arch. Toxic. Supplem., 9, 386 (1986). |
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