Chemical Properties of 2H-Pyran-2-one, 6-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-dihydro-4-methoxy-, (S)- (CAS 38146-60-0)

2H-Pyran-2-one, 6-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-dihydro-4-methoxy-, (S)-

InChI
InChI=1S/C16H20O5/c1-18-13-9-12(21-16(17)10-13)6-4-11-5-7-14(19-2)15(8-11)20-3/h5,7-8,10,12H,4,6,9H2,1-3H3/t12-/m1/s1
InChI Key
HEURTYMJWQPWNN-GFCCVEGCSA-N
Formula
C16H20O5
SMILES
COC1=CC(=O)OC(CCc2ccc(OC)c(OC)c2)C1
Molecular Weight1
292.33
CAS
38146-60-0
Other Names
  • Tetrahydro-11-methoxyiangonin
  • (S)-6-(3,4-Dimethoxyphenethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one
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Physical Properties

Property Value Unit Source
ΔfusH° 35.26 kJ/mol Joback Calculated Property
IE 8.16 eV Relay (1.0) Calculated Property
logPoct/wat 2.482 Crippen Calculated Property
McVol 222.430 ml/mol McGowan Calculated Property
Inp [2615.30; 2615.30]   Show Hide
Inp 2615.30 NIST
Inp 2615.30 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [323.04; 730.96] 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 A5.16620e+01
Coefficient B1.10736e+00
Coefficient C-4.10160e-04
Coefficient D-1.79000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 323.04 J/mol×K 273.00 Calculated Property
Cp,gas 391.29 J/mol×K 353.78 Calculated Property
Cp,gas 453.95 J/mol×K 434.56 Calculated Property
Cp,gas 510.95 J/mol×K 515.33 Calculated Property
Cp,gas 562.23 J/mol×K 596.11 Calculated Property
Cp,gas 607.74 J/mol×K 676.89 Calculated Property
Cp,gas 647.43 J/mol×K 757.67 Calculated Property
Cp,gas 681.23 J/mol×K 838.44 Calculated Property
Cp,gas 709.10 J/mol×K 919.22 Calculated Property
Cp,gas 730.96 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0005949; 0.0001465] Pa×s [458.26; 666.70] 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-1.19101e+01
Coefficient B2.05440e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.458.26
Temperature range, max.666.70
η 0.0005949 Pa×s 458.26 Calculated Property
η 0.0004795 Pa×s 481.42 Calculated Property
η 0.0003942 Pa×s 504.58 Calculated Property
η 0.0003297 Pa×s 527.74 Calculated Property
η 0.0002799 Pa×s 550.90 Calculated Property
η 0.0002408 Pa×s 574.06 Calculated Property
η 0.0002096 Pa×s 597.22 Calculated Property
η 0.0001844 Pa×s 620.38 Calculated Property
η 0.0001637 Pa×s 643.54 Calculated Property
η 0.0001465 Pa×s 666.70 Calculated Property

Similar Compounds

(S)-6-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one. 4-Methoxy-6-(4-methoxyphenethyl)-5,6-dihydro-2H-pyran-2-one. (E)-4-(2-(2-(2,6-Dimethylhepta-1,5-dien-1-yl)-6-pentyl-1,3-dioxan-4-yl)ethyl)-2-methoxyphenol. (S)-4-Methoxy-6-phenethyl-5,6-dihydro-2H-pyran-2-one. (E)-Methyl 2-((1'R,6'R,7'S,8a'S)-6'-ethyl-2-oxo-3',5',6',7',8',8a'-hexahydro-2'H-spiro[indoline-3,1'-indolizin]-7'-yl)-3-methoxyacrylate. QUINIDINE, M(HO-), AC. Dihydrocodeine tms derivative. 6-Monoacetylmorphine. Nicocodine. Strychnine. DIHYDROERGOKRYPTINE. AJMALINE, M(DIHYDRO-), AC. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. BUPRENORPHINE. TCN.

Find more compounds similar to 2H-Pyran-2-one, 6-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-dihydro-4-methoxy-, (S)-.

Sources

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