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  • 2,2-Bis(4-Hydroxy-3-Methylphenyl)Propane

  • 2,2-Bis(4-Hydroxy-3-Methylphenyl)Propane

    Catalog Number
    ACM79970-1
    CAS Number
    79-97-0
    Product Name
    2,2-Bis(4-Hydroxy-3-Methylphenyl)Propane
    Category
    Pressure & Heat Sensitive Recording Materials; Heat & Pressure Sensitive Dyes; Monomers; Polymers
    Synonyms
    4-[2-(4-Hydroxy-3-Methylphenyl)Propan-2-Yl]-2-Methylphenol
    IUPAC Name
    4-[2-(4-Hydroxy-3-methylphenyl)propan-2-yl]-2-methylphenol
    Molecular Weight
    256.34
    Molecular Formula
    C17H20O2
    Canonical SMILES
    CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)O)C)O
    InChI
    InChI=1S/C17H20O2/c1-11-9-13(5-7-15(11)18)17(3,4)14-6-8-16(19)12(2)10-14/h5-10,18-19H,1-4H3
    InChI Key
    YMTYZTXUZLQUSF-UHFFFAOYSA-N
    Boiling Point
    238-240 °C (lit.) at 12 mmHg
    Melting Point
    138-140 °C
    Purity
    95%
    Density
    1.0421 g/cm3
    Appearance
    Powder or crystalline or crystalline powder or chunks
    Application
    2,2-Bis(4-Hydroxy-3-Methylphenyl)Propane serves as a crucial component in the development of thermosensitive recording materials, acting specifically as a color-developer. This compound is a type of bisphenol and functions as a monomer for the production of polycarbonate and bisphenol A. In various applications, it is used in reaction solutions with sodium salt and calcium stearate, and it can interact with fatty acids to yield aromatic hydrocarbons. During these reactions, it yields hydrogen chloride and hydrochloric acid as byproducts.
    Complexity
    272
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    EC Number
    201-240-0
    Exact Mass
    256.146329876
    Formal Charge
    0
    Heavy Atom Count
    19
    Hydrogen Bond Acceptor Count
    2
    Hydrogen Bond Donor Count
    2
    Isotope Atom Count
    0
    MeSH Entry Terms
    4-(2,2-dichloro-1-(4-hydroxyphenyl)ethenyl)phenol;bisphenol C
    Monoisotopic Mass
    256.146329876
    NSC Number
    408489
    Rotatable Bond Count
    2
    Topological Polar Surface Area
    40.5 Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    UNII
    98817I7XJ2
    XLogP3
    4.7
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