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  • 3,3-Dimethyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine

  • 3,3-Dimethyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine

    Catalog Number
    ACM255901509-2
    CAS Number
    255901-50-9
    Product Name
    3,3-Dimethyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine
    Structure
    Category
    Polymers
    Synonyms
    3,4-(2,2-Dimethylpropylenedioxy)thiophene
    IUPAC Name
    3,3-dimethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine
    Molecular Weight
    184.26
    Molecular Formula
    C9H12O2S
    Canonical SMILES
    CC1(COC2=CSC=C2OC1)C
    InChI
    InChI=1S/C9H12O2S/c1-9(2)5-10-7-3-12-4-8(7)11-6-9/h3-4H,5-6H2,1-2H3
    InChI Key
    PUEUIEYRIVFGLS-UHFFFAOYSA-N
    Boiling Point
    239.6±9.0 ºC
    Melting Point
    41-46 ºC
    Purity
    97%+
    Density
    1.123±0.06 g/ml
    Complexity
    154
    Covalently-Bonded Unit Count
    1
    Exact Mass
    184.055801g/mol
    Formal Charge
    0
    Heavy Atom Count
    12
    Monoisotopic Mass
    184.055801g/mol
    Rotatable Bond Count
    0
    XLogP3
    2.5
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