Chemical Properties of Cyclopropa[c]2h-1-benzopyran,3,4-dihydro-4-phenyl-

Cyclopropa[c]2h-1-benzopyran,3,4-dihydro-4-phenyl-

InChI
InChI=1S/C16H14O/c1-2-6-12(7-3-1)16-10-13(16)11-17-15-9-5-4-8-14(15)16/h1-9,13H,10-11H2
InChI Key
WARAYOPBTKJQFK-UHFFFAOYSA-N
Formula
C16H14O
SMILES
c1ccc(C23CC2COc2ccccc23)cc1
Molecular Weight1
222.29
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 24.94 kJ/mol Joback Calculated Property
logPoct/wat 3.385 Crippen Calculated Property
McVol 172.930 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [204.38; 589.24] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.93200e+02
Coefficient B1.90680e+00
Coefficient C-1.84746e-03
Coefficient D7.23100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 204.38 J/mol×K 273.00 Calculated Property
Cp,gas 282.18 J/mol×K 353.78 Calculated Property
Cp,gas 345.88 J/mol×K 434.56 Calculated Property
Cp,gas 397.77 J/mol×K 515.33 Calculated Property
Cp,gas 440.14 J/mol×K 596.11 Calculated Property
Cp,gas 475.28 J/mol×K 676.89 Calculated Property
Cp,gas 505.48 J/mol×K 757.67 Calculated Property
Cp,gas 533.01 J/mol×K 838.44 Calculated Property
Cp,gas 560.17 J/mol×K 919.22 Calculated Property
Cp,gas 589.24 J/mol×K 1000.00 Calculated Property

Similar Compounds

4-Phenyl-4-chromancarboxamide. 5-Phenyl-2,3,4,5-tetrahydrobenzoxepin-5-carboxamide. Pyrrolidine, 1-(2,3-dihydro-4-pheynl-1(4h)-benzopyran-4-carbonyl)-. 1(7)-Tetrahydrocannabinol, TBDMS. 11-Hydroxy-.DELTA.-9-tetrahydrocannabinol, bis(trimethylsilyl) ether. Cannabinol, TMS. 1-Tetrahydrocannabinol, TMS. 6H-Dibenzo[b,d]pyran, 6a,7,8,10a-tetrahydro-6,6,9-trimethyl-3-pentyl-1-[(trimethylsilyl)oxy]-, (6aR-trans)-. Heptyl-1-tetrahydrocannabinol, TMS. Propyl-1-tetrahydrocannabinol, TMS. 1-Tetrahydrocannabinol, 6«alpha»-hydroxy, TMS. narwedine. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. 1-Tetrahydrocannabinol, 6.alpha.-hydroxy, TBDMS. 1-Tetrahydrocannabinol, 6«alpha»-hydroxy, allyl-DMS.

Find more compounds similar to Cyclopropa[c]2h-1-benzopyran,3,4-dihydro-4-phenyl-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.