Chemical Properties of 4H-Pyran-4-one, 2-methoxy-6-methyl- (CAS 4225-42-7)

4H-Pyran-4-one, 2-methoxy-6-methyl-

InChI
InChI=1S/C7H8O3/c1-5-3-6(8)4-7(9-2)10-5/h3-4H,1-2H3
InChI Key
SGHBBBQKUYEJPS-UHFFFAOYSA-N
Formula
C7H8O3
SMILES
COc1cc(=O)cc(C)o1
Molecular Weight1
140.14
CAS
4225-42-7
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Physical Properties

Property Value Unit Source
Δvap 71.00 ± 3.00 kJ/mol NIST
IE 8.60 eV Relay (1.0) Calculated Property
logPoct/wat 0.957 Crippen Calculated Property
McVol 103.340 ml/mol McGowan Calculated Property
Tboil 515.39 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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

Property Value Unit Temperature (K) Source
ΔvapH 72.80 kJ/mol 377.00 NIST

Similar Compounds

4H-Pyran-4-one, 2,6-dimethyl-. 6-Methyl-2-methylthio-4-pyrone. Rubrofusarin, TMS. Khellin. 4H-Pyran-4-one, 5-hydroxy-2-methyl-. Toralactone, TMS. Urea,[4-(2-furylmethyl(methyl)amino)-2,2-diphenyl-n-butyl]-. 4H-1-Benzopyran-4-one, 2-methyl-. Butamifos. Glyburide. Oxypertine. MIANSERIN. 2,6-Methano-1,4(2h)-benzoxazocin-5(6h)-one,4(3h)-cyclohexyl-6-phenyl-. Indomethacin, ethyl ester. 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1,2,3,4-tetrahydro-1-naphthalenyl)-.

Find more compounds similar to 4H-Pyran-4-one, 2-methoxy-6-methyl-.

Sources

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