4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)benzoic acid
Weight267.328 g/mol
FormulaC17H17NO2
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings2
Rotatable Bonds3

4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)benzoic acid (333357-96-3)

333357-96-3

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Alternate Names

  • 333357-96-3
  • SMILES
    C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)O
  • InChIKey
    YGDCSVTTWQYOCN-UHFFFAOYSA-N

Estimated Properties

Boiling Point 369.17 C EPA T.E.S.T.
Boiling Point 419.46 C EPI Suite
Density 1.2 g/cm3 EPA T.E.S.T.
Flash Point 216.96 C EPA T.E.S.T.
Melting Point 172.5 C EPI Suite
Water Solubility 72.74 mg/L EPA T.E.S.T.
Water Solubility 20.948 mg/L EPI Suite

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