Chemical Properties of (S)-6-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one (CAS 19902-91-1)

(S)-6-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one

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InChI
InChI=1S/C15H16O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h3,5-6,8,11H,2,4,7,9H2,1H3/t11-/m1/s1
InChI Key
RSIWXFIBHXYNFM-LLVKDONJSA-N
Formula
C15H16O5
SMILES
COC1=CC(=O)OC(CCc2ccc3c(c2)OCO3)C1
Molecular Weight1
276.28
CAS
19902-91-1
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Physical Properties

Property Value Unit Source
ΔfG° -204.14 kJ/mol Joback Calculated Property
ΔfH°gas -611.49 kJ/mol Joback Calculated Property
ΔfusH° 42.24 kJ/mol Joback Calculated Property
ΔvapH° 74.38 kJ/mol Joback Calculated Property
log10WS -3.30 Crippen Calculated Property
logPoct/wat 2.194 Crippen Calculated Property
McVol 197.480 ml/mol McGowan Calculated Property
Pc 2558.51 kPa Joback Calculated Property
Inp [2571.80; 2571.80]   Show Hide
Inp 2571.80 NIST
Inp 2571.80 NIST
Tboil 785.43 K Joback Calculated Property
Tc 1030.55 K Joback Calculated Property
Tfus 523.27 K Joback Calculated Property
Vc 0.733 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [600.99; 675.33] J/mol×K [785.43; 1030.55] Show Hide
Cp,gas 600.99 J/mol×K 785.43 Joback Calculated Property
Cp,gas 616.69 J/mol×K 826.28 Joback Calculated Property
Cp,gas 631.03 J/mol×K 867.14 Joback Calculated Property
Cp,gas 644.04 J/mol×K 907.99 Joback Calculated Property
Cp,gas 655.74 J/mol×K 948.85 Joback Calculated Property
Cp,gas 666.16 J/mol×K 989.70 Joback Calculated Property
Cp,gas 675.33 J/mol×K 1030.55 Joback Calculated Property

Similar Compounds

2H-Pyran-2-one, 6-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-dihydro-4-methoxy-, (S)-. 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. 6-Monoacetylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to (S)-6-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)-4-methoxy-5,6-dihydro-2H-pyran-2-one.

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