Chemical Properties of (3R,4R)-4-(Benzo[d][1,3]dioxol-5-ylmethyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one (CAS 40456-50-6)

(3R,4R)-4-(Benzo[d][1,3]dioxol-5-ylmethyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one

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InChI
InChI=1S/C22H24O7/c1-24-19-9-14(10-20(25-2)21(19)26-3)7-16-15(11-27-22(16)23)6-13-4-5-17-18(8-13)29-12-28-17/h4-5,8-10,15-16H,6-7,11-12H2,1-3H3/t15-,16+/m1/s1
InChI Key
GMLDZDDTZKXJLU-CVEARBPZSA-N
Formula
C22H24O7
SMILES
COc1cc(CC2C(=O)OCC2Cc2ccc3c(c2)OCO3)cc(OC)c1OC
Molecular Weight1
400.42
CAS
40456-50-6
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Physical Properties

Property Value Unit Source
ΔfG° -287.62 kJ/mol Joback Calculated Property
ΔfH°gas -878.78 kJ/mol Joback Calculated Property
ΔfusH° 57.95 kJ/mol Joback Calculated Property
ΔvapH° 97.61 kJ/mol Joback Calculated Property
log10WS -4.41 Crippen Calculated Property
logPoct/wat 3.015 Crippen Calculated Property
McVol 288.390 ml/mol McGowan Calculated Property
Pc 1631.17 kPa Joback Calculated Property
Inp 3225.80 NIST
Tboil 1018.97 K Joback Calculated Property
Tc 1265.82 K Joback Calculated Property
Tfus 696.60 K Joback Calculated Property
Vc 1.073 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [984.41; 1025.30] J/mol×K [1018.97; 1265.82] Show Hide
Cp,gas 984.41 J/mol×K 1018.97 Joback Calculated Property
Cp,gas 996.20 J/mol×K 1060.11 Joback Calculated Property
Cp,gas 1005.99 J/mol×K 1101.25 Joback Calculated Property
Cp,gas 1013.79 J/mol×K 1142.39 Joback Calculated Property
Cp,gas 1019.61 J/mol×K 1183.53 Joback Calculated Property
Cp,gas 1023.44 J/mol×K 1224.68 Joback Calculated Property
Cp,gas 1025.30 J/mol×K 1265.82 Joback Calculated Property

Similar Compounds

(3R,4R)-3-(Benzo[d][1,3]dioxol-5-ylmethyl)-4-(3,4-dimethoxybenzyl)dihydrofuran-2(3H)-one. (3R,4R)-3-(Benzo[d][1,3]dioxol-5-ylmethyl)-4-((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)dihydrofuran-2(3H)-one. 2(3H)-Furanone, 3,4-bis(1,3-benzodioxol-5-ylmethyl)dihydro-, (3R-trans)-. (3R,4R)-4-(3,4-Dimethoxybenzyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one. (3R,4R)-3-((7-Methoxybenzo[d][1,3]dioxol-5-yl)methyl)-4-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one. (3R,4R)-3,4-bis(3,4,5-Trimethoxybenzyl)dihydrofuran-2(3H)-one. (3R)-trans-Dihydro-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone diTMS. Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5«alpha»,5a«beta»,8a«alpha»)]-. tetrahydro-3,4-dipiperonylfuran-2-ol. Quinidine. Quinine. 5,6-Dihydrouracil riboside, TMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. xanthosine-5'-monophosphate, TMS.

Find more compounds similar to (3R,4R)-4-(Benzo[d][1,3]dioxol-5-ylmethyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3H)-one.

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