Chemical Properties of 6-Chloro-4-chromanone (CAS 37674-72-9)

6-Chloro-4-chromanone

InChI
InChI=1S/C9H7ClO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2
InChI Key
LLTDYHFVIVSQPJ-UHFFFAOYSA-N
Formula
C12H16
SMILES
O=C1CCOc2ccc(Cl)cc21
Molecular Weight1
160.26
CAS
37674-72-9
Other Names
  • 4H-1-Benzopyran-4-one, 6-chloro-2,3-dihydro-
  • 6-chlorochroman-4-one
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Physical Properties

Property Value Unit Source
ΔfusH° 18.98 kJ/mol Joback Calculated Property
logPoct/wat 2.305 Crippen Calculated Property
McVol 122.730 ml/mol McGowan Calculated Property
Tboil 559.30 K Relay (1.0) Calculated Property
Tfus 236.30 ± 1.00 K NIST

Cheméo can also estimate 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, Ionization energy, 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

Property Value Unit Temperature (K) Source
Cp,gas [274.73; 337.13] J/mol×K [589.84; 846.40] Show Hide
Cp,gas 274.73 J/mol×K 589.84 Joback Calculated Property
Cp,gas 287.30 J/mol×K 632.60 Joback Calculated Property
Cp,gas 298.97 J/mol×K 675.36 Joback Calculated Property
Cp,gas 309.76 J/mol×K 718.12 Joback Calculated Property
Cp,gas 319.70 J/mol×K 760.88 Joback Calculated Property
Cp,gas 328.82 J/mol×K 803.64 Joback Calculated Property
Cp,gas 337.13 J/mol×K 846.40 Joback Calculated Property

Similar Compounds

4H-1-Benzopyran-4-one, 2,3-dihydro-. Ketocaine. Flavanone. 1-{2-[2-(Diethylamino)ethoxy]phenyl}-3-phenylpropan-1-one. 2',5'-Dimethoxypropiophenone. 5,7-Dihydroxy-2-(2-methoxyphenyl)-2,3-dihydro-4h-chromen-4-one. 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-2-phenyl-. 5,6,7,4'-Tetramethoxyflavanone. 1,2-Diacetoxy-3-[2-(3-phenylpropionyl)phenoxy]propane. 5,7-Dimethoxy-2-(4-methoxyphenyl)chroman-4-one. Dihydrodaidzein (keto). 2,2-dimethyl-6-vinylchroman-4-one. Pinostrobin. 3',4',5,6,7-Pentamethoxyflavanone. Dihydrodaidzein (keto) di-7,4'-d9-TMS.

Find more compounds similar to 6-Chloro-4-chromanone.

Sources

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