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| IUPAC Name: | 2-(8-hydroxyoctoxycarbonyl)benzoate |
| Description: | Mono-8-hydroxyoctyl Phthalate is a metabolite of phthalate which is widely used in consumer products. |
| Molecular Weight: | 294.34 |
| Molecular Formula: | C16H22O5 |
| Canonical SMILES: | C1=CC=C(C(=C1)C(=O)[O-])C(=O)OCCCCCCCCO |
| InChI: | InChI=1S/C16H22O5/c17-11-7-3-1-2-4-8-12-21-16(20)14-10-6-5-9-13(14)15(18)19/h5-6,9-10,17H,1-4,7-8,11-12H2,(H,18,19)/p-1 |
| InChI Key: | CKASXCCQWJHYCJ-UHFFFAOYSA-M |
| References: | Silva, M., et al. Arch. Toxicol., 77, 561 (2003), Silva, M., et al. Toxicology, 210, 123 (2005), Silva, M., et al. J. Anal. Toxicol., 29, 819, (2005),. |
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