Chemical Properties of GA3-13-O-glucoside, permethylated

GA3-13-O-glucoside, permethylated

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InChI
InChI=1S/C31H44O11/c1-16-13-29-15-30(16,41-26-23(38-7)22(37-6)21(36-5)17(40-26)14-34-3)11-9-18(29)31-12-10-19(35-4)28(2,27(33)42-31)24(31)20(29)25(32)39-8/h10,12,17-24,26H,1,9,11,13-15H2,2-8H3/t17-,18-,19+,20-,21-,22+,23-,24-,26+,28-,29+,30+,31-/m0/s1
InChI Key
LNVOHHIQKUEONS-VWAQXLAKSA-N
Formula
C31H44O11
SMILES
C=C1CC23CC1(OC1OC(COC)C(OC)C(OC)C1OC)CCC2C12C=CC(OC)C(C)(C(=O)O1)C2C3C(=O)OC
Molecular Weight1
592.67
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Physical Properties

Property Value Unit Source
Δf -637.50 kJ/mol Joback Calculated Property
Δfgas -1656.39 kJ/mol Joback Calculated Property
Δfus 62.11 kJ/mol Joback Calculated Property
Δvap 115.50 kJ/mol Joback Calculated Property
log10WS -3.39 Crippen Calculated Property
logPoct/wat 2.210 Crippen Calculated Property
McVol 429.860 ml/mol McGowan Calculated Property
Pc 905.06 kPa Joback Calculated Property
Inp 3515.00 NIST
Tboil 1269.59 K Joback Calculated Property
Tc 1558.60 K Joback Calculated Property
Tfus 936.43 K Joback Calculated Property
Vc 1.609 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [2021.95; 2630.16] J/mol×K [1269.59; 1558.60] Show Hide
Cp,gas 2021.95 J/mol×K 1269.59 Joback Calculated Property
Cp,gas 2101.70 J/mol×K 1317.76 Joback Calculated Property
Cp,gas 2188.98 J/mol×K 1365.93 Joback Calculated Property
Cp,gas 2284.63 J/mol×K 1414.10 Joback Calculated Property
Cp,gas 2389.48 J/mol×K 1462.27 Joback Calculated Property
Cp,gas 2504.38 J/mol×K 1510.43 Joback Calculated Property
Cp,gas 2630.16 J/mol×K 1558.60 Joback Calculated Property

Similar Compounds

GA3-3«beta»-O-glucoside, permethylated. GA7-3«beta»-O-glucoside, permethylated. 3-epiGA1-13-O-«beta»-D-glucopyranoside, permethyl. GA8-13-O-glucoside, permethylated. GA1, 13-O-glucoside, permethylated. GA1-13-O-«beta»-D-glucopyranoside, permethyl. 3-epi-GA1-13-O-glucoside, permethylated. GA1-3«beta»-O-glucoside, permethylated. GA8-2-O-«beta»-D-glucopyranoside, permethyl. 3-epi-GA1-3«alpha»-O-glucoside, permethylated. 3-epiGA1-3-O-«beta»-D-glucopyranoside, permethyl. GA1-3-O-«beta»-D-glucopyranoside, permethyl. GA8-2«beta»-O-glucoside, permethylated. GA8-2-O-glucoside, permethyl. azadirachtin.

Find more compounds similar to GA3-13-O-glucoside, permethylated.

Sources

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