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  • 2-Ethylhexyl 2-cyano-3,3-diphenylacrylate, 97%

  • 2-Ethylhexyl 2-cyano-3,3-diphenylacrylate, 97%

    Catalog Number
    ACM6197304-1
    CAS Number
    6197-30-4
    Product Name
    2-Ethylhexyl 2-cyano-3,3-diphenylacrylate, 97%
    Structure
    Category
    Plastic Additives
    Description
    2-ethylhexyl-2-cyano-3,3-diphenylacrylate is a yellow viscous liquid. Insoluble in water. (NTP, 1992);Liquid
    IUPAC Name
    2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
    Molecular Weight
    361.5g/mol
    Molecular Formula
    C24H27NO2
    Canonical SMILES
    CCCCC(CC)COC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N
    InChI
    InChI=1S/C24H27NO2/c1-3-5-12-19(4-2)18-27-24(26)22(17-25)23(20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19H,3-5,12,18H2,1-2H3
    InChI Key
    FMJSMJQBSVNSBF-UHFFFAOYSA-N
    Solubility
    Insoluble (NTP, 1992)
    Application
    2-Ethylhexyl 2-cyano-3,3-diphenylacrylate, 97%, is a versatile ingredient predominantly used in sunscreen formulations for its ability to effectively absorb UVB rays, offering protection against sun damage. This clear yellow, viscous liquid with a mild characteristic odor is miscible with solvents like methanol, n-butanol, ethyl acetate, and various oils, while being immiscible in water. As an oil-soluble UVB filter, it not only enhances the sun protection factor (SPF) of skincare products but also contributes to their water-resistant properties by improving the photostability of other active ingredients. The molecular structure, with its extended conjugation, allows for absorption of short-wave UVA rays as well, further contributing to skin protection. While it offers significant benefits in boosting UV protection and water resistance, the cost and complexity of its formulation, along with potential allergenic responses in individuals with photoallergic skin conditions, present some challenges in its use. Nonetheless, 2-Ethylhexyl 2-cyano-3,3-diphenylacrylate remains a popular choice for enhancing the efficacy of sun care and cosmetic products.
    Complexity
    510
    Covalently-Bonded Unit Count
    1
    EC Number
    228-250-8
    Exact Mass
    361.204179g/mol
    Formal Charge
    0
    Heavy Atom Count
    27
    MeSH Entry Terms
    2-ethylhexyl 2-cyano-3,3-diphenyl-2-propenoate;2-ethylhexyl 2-cyano-3,3-diphenylacrylate;octocrylene
    Monoisotopic Mass
    361.204179g/mol
    Rotatable Bond Count
    10
    XLogP3
    7.1
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