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  • 7-(Diethylamino)coumarin-3-carboxylic Acid

  • 7-(Diethylamino)coumarin-3-carboxylic Acid

    Catalog Number
    ACM50995749-2
    CAS Number
    50995-74-9
    Product Name
    7-(Diethylamino)coumarin-3-carboxylic Acid
    Structure
    Category
    Coumarin Dyes; Other Materials
    Synonyms
    7-Diethylaminocoumarin-3-carboxylicacid
    IUPAC Name
    7-(diethylamino)-2-oxochromene-3-carboxylicacid
    Molecular Weight
    261.28
    Molecular Formula
    C14H15NO4
    Canonical SMILES
    CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O
    InChI
    InChI=1S/C14H15NO4/c1-3-15(4-2)10-6-5-9-7-11(13(16)17)14(18)19-12(9)8-10/h5-8H,3-4H2,1-2H3,(H,16,17)
    InChI Key
    WHCPTFFIERCDSB-UHFFFAOYSA-N
    Boiling Point
    464.7 ± 45.0 °C
    Melting Point
    222 - 224 °C
    Purity
    ≥95%
    Density
    1.317 ± 0.06 g/ml
    Appearance
    Powder or solid
    Storage
    -20 °C in the dark
    Complexity
    400
    Covalently-Bonded Unit Count
    1
    Exact Mass
    261.100108g/mol
    Formal Charge
    0
    Heavy Atom Count
    19
    MeSH Entry Terms
    7-DEACCA;7-diethylaminocoumarin-3-carboxylic acid
    Monoisotopic Mass
    261.100108g/mol
    Rotatable Bond Count
    4
    XLogP3
    3.1
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