Chemical Properties of 2H-1-Benzopyran-2-one, 7-amino-4-(trifluoromethyl)-

InChI

InChI=1S/C10H6F3NO2/c11-10(12,13)7-4-9(15)16-8-3-5(14)1-2-6(7)8/h1-4H,14H2

InChI Key

JBNOVHJXQSHGRL-UHFFFAOYSA-N

Formula

C10H6F3NO2

SMILES

Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1

Molecular Weight¹

229.16

Other Names

• 7-Amino-4-(trifluoromethyl)coumarin
• Coumarin 151
• 7-Amino-4-trifluoromethyl-chromen-2-one
• 7-amino-4-(trifluoromethyl)-2-benzopyrone
• 4-Trifluoromethyl-7-aminocoumarin

• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 2H-1-Benzopyran-2-one, 7-amino-4-(trifluoromethyl)-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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