Chemical Properties of 4-Hydroxy-5,6-dihydro-2H-pyran-2-one

4-Hydroxy-5,6-dihydro-2H-pyran-2-one

InChI
InChI=1S/C5H6O3/c6-4-1-2-8-5(7)3-4/h3,6H,1-2H2
InChI Key
NJGFHHXZSDLYQJ-UHFFFAOYSA-N
Formula
C5H6O3
SMILES
O=C1C=C(O)CCO1
Molecular Weight1
114.10
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
ΔfH°gas -469.73 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 12.96 kJ/mol Joback Calculated Property
ΔvapH° 75.76 kJ/mol Relay (1.0) Calculated Property
IE 9.38 eV Relay (1.0) Calculated Property
logPoct/wat 0.375 Crippen Calculated Property
McVol 79.460 ml/mol McGowan Calculated Property
Inp [1004.00; 1004.00]   Show Hide
Inp 1004.00 NIST
Inp 1004.00 NIST
I [1842.00; 1842.00]   Show Hide
I 1842.00 NIST
I 1842.00 NIST
Tboil 530.08 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [105.87; 244.58] 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-1.01800e+01
Coefficient B5.10300e-01
Coefficient C-3.33440e-04
Coefficient D7.79000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 105.87 J/mol×K 273.00 Calculated Property
Cp,gas 132.07 J/mol×K 353.78 Calculated Property
Cp,gas 155.00 J/mol×K 434.56 Calculated Property
Cp,gas 174.90 J/mol×K 515.33 Calculated Property
Cp,gas 192.03 J/mol×K 596.11 Calculated Property
Cp,gas 206.62 J/mol×K 676.89 Calculated Property
Cp,gas 218.93 J/mol×K 757.67 Calculated Property
Cp,gas 229.19 J/mol×K 838.44 Calculated Property
Cp,gas 237.66 J/mol×K 919.22 Calculated Property
Cp,gas 244.58 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0134037; 0.0002758] Pa×s [281.20; 473.53] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.38739e+01
Coefficient B2.68875e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.281.20
Temperature range, max.473.53
η 0.0134037 Pa×s 281.20 Calculated Property
η 0.0068225 Pa×s 302.57 Calculated Property
η 0.0037962 Pa×s 323.94 Calculated Property
η 0.0022713 Pa×s 345.31 Calculated Property
η 0.0014428 Pa×s 366.68 Calculated Property
η 0.0009634 Pa×s 388.05 Calculated Property
η 0.0006711 Pa×s 409.42 Calculated Property
η 0.0004845 Pa×s 430.79 Calculated Property
η 0.0003607 Pa×s 452.16 Calculated Property
η 0.0002758 Pa×s 473.53 Calculated Property

Similar Compounds

5,6-Dihydro-4-methoxy-2H-pyran. 5,6-DIHYDRO-2H-PYRAN-2-ONE. Dehydromevalonic lactone. 2,5-Dimethyl-4-hydroxy-2(5H)-furanone. 2-Hexenoic acid, 3-hexenyl ester, (E,Z)-. (3E,10Z)-Oxacyclotrideca-3,10-diene-2,7-dione. 2H-Pyran-2-one, 5,6-dihydro-4-methoxy-6-(2-phenylethenyl)-, [R-(E)]-. (S)-4-Methoxy-6-phenethyl-5,6-dihydro-2H-pyran-2-one. 2-Butenoic acid, 3-hexenyl ester, (E,Z)-. Fumaric acid, di(cis-non-3-enyl) ester. Fumaric acid, cis-non-3-enyl propyl ester. Ascorbic acid, tetraacetate. D-(-)-Isoascorbic acid, tetraacetate. 4-Methoxy-6-(4-methoxyphenethyl)-5,6-dihydro-2H-pyran-2-one. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl trans-hex-3-en-1-yl ester.

Find more compounds similar to 4-Hydroxy-5,6-dihydro-2H-pyran-2-one.

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.