7-Hydroxyheptanoic Acid Phenylmethyl Ester - CAS 59379-00-9

Catalog: BB056225
Product Name: 7-Hydroxyheptanoic Acid Phenylmethyl Ester
CAS: 59379-00-9
Synonyms: Benzyl 7-Hydroxyheptanoate
7-Hydroxyheptanoic Acid Phenylmethyl Ester
IUPAC Name:benzyl 7-hydroxyheptanoate
Description:7-Hydroxyheptanoic Acid Phenylmethyl Ester is an intermediate used to prepare 5-Carboxyhexyl Phthalate (C178560), a metabolite of Dibutyl phthalate (DBP) (D429495), which is widely used in consumer products.
Molecular Weight:236.31
Molecular Formula:C14H20O3
Canonical SMILES:C1=CC=C(C=C1)COC(=O)CCCCCCO
InChI:InChI=1S/C14H20O3/c15-11-7-2-1-6-10-14(16)17-12-13-8-4-3-5-9-13/h3-5,8-9,15H,1-2,6-7,10-12H2
InChI Key:QOHOZLMRQAWMDY-UHFFFAOYSA-N
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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