isoamyl 4-methoxycinnamate

Synonyms: "Isoamyl 4-methoxycinnamate", "71617-10-2", "Isopentyl 3-(4-methoxyphenyl)acrylate", "Isopentyl 4-methoxycinnamate", "Isoamyl p-methoxycinnamate", "Isopentyl p-methoxycinnamate", "isoamyl-p-methoxycinnamate", "ISOAMYL METHOXYCINNAMATE", "3-Methylbutyl 3-(4-methoxyphenyl)-2-propenoate".

Source: Isoamyl 4-Methoxycinnamate is used in the highly protective sunscreen composition against the UVA/UVB.

Identifiers:

IUPAC Name: 3-methylbutyl (E)-3-(4-methoxyphenyl)prop-2-enoate
CAS Number: 71617-10-2
PubChem ID: 1549789
InChiKey: UBNYRXMKIIGMKK-RMKNXTFCSA-N
Canonical SMILES: CC(C)CCOC(=O)C=CC1=CC=C(C=C1)OC

Structural Properties:

Molecular Formula: C₁₅H₂₀O₃
Molecular Weight: 248.322

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 3
Number of atoms different from hydrogen: 18

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Kunz PY, Fent K. 2006. Multiple hormonal activities of UV filters and comparison of in vivo and in vitro estrogenic activity of ethyl-4-aminobenzoate in fish. Aquat Toxicol 79(4):305-324. DOI: 10.1016/j.aquatox.2006.06.016. URL: https://www.sciencedirect.com/science/article/pii/S0166445X06002700.