Chemical Properties of Isopentyl glucuronide, methyl ester, triacetate

Isopentyl glucuronide, methyl ester, triacetate

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InChI
InChI=1S/C18H28O10/c1-9(2)7-8-24-18-16(27-12(5)21)14(26-11(4)20)13(25-10(3)19)15(28-18)17(22)23-6/h9,13-16,18H,7-8H2,1-6H3
InChI Key
QJLSBRRINCGZRM-UHFFFAOYSA-N
Formula
C18H28O10
SMILES
COC(=O)C1OC(OCCC(C)C)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
Molecular Weight1
404.41
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Physical Properties

Property Value Unit Source
Δf -1034.95 kJ/mol Joback Calculated Property
Δfgas -1690.59 kJ/mol Joback Calculated Property
Δfus 55.29 kJ/mol Joback Calculated Property
Δvap 98.01 kJ/mol Joback Calculated Property
log10WS -1.69 Crippen Calculated Property
logPoct/wat 0.742 Crippen Calculated Property
McVol 295.120 ml/mol McGowan Calculated Property
Pc 1364.66 kPa Joback Calculated Property
Inp 2095.00 NIST
Tboil 966.20 K Joback Calculated Property
Tc 1184.88 K Joback Calculated Property
Tfus 605.48 K Joback Calculated Property
Vc 1.101 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1017.31; 1053.48] J/mol×K [966.20; 1184.88] Show Hide
Cp,gas 1017.31 J/mol×K 966.20 Joback Calculated Property
Cp,gas 1029.09 J/mol×K 1002.65 Joback Calculated Property
Cp,gas 1038.66 J/mol×K 1039.09 Joback Calculated Property
Cp,gas 1045.95 J/mol×K 1075.54 Joback Calculated Property
Cp,gas 1050.89 J/mol×K 1111.98 Joback Calculated Property
Cp,gas 1053.42 J/mol×K 1148.43 Joback Calculated Property
Cp,gas 1053.48 J/mol×K 1184.88 Joback Calculated Property
η [0.0000645; 0.0004098] Pa×s [605.48; 966.20] Show Hide
η 0.0004098 Pa×s 605.48 Joback Calculated Property
η 0.0002620 Pa×s 665.60 Joback Calculated Property
η 0.0001804 Pa×s 725.72 Joback Calculated Property
η 0.0001315 Pa×s 785.84 Joback Calculated Property
η 0.0001003 Pa×s 845.96 Joback Calculated Property
η 0.0000792 Pa×s 906.08 Joback Calculated Property
η 0.0000645 Pa×s 966.20 Joback Calculated Property

Similar Compounds

Butyl glucuronide, methyl ester, triacetate. Ethyl glucuronide, methyl ester, triacetate. Propyl glucuronide, methyl ester, triacetate. (S)-2-Methylbutyl glucuronide, methyl ester, triacetate. Isobutyl glucuronide, methyl ester, triacetate. Isopropyl glucuronide, methyl ester, triacetate. Isopentyl glucuronide, acetate. (R)-2-Butyl glucuronide, methyl ester, triacetate. (S)-2-Butyl glucuronide, methyl ester, triacetate. Methyl(methyl 2,3,4-tri-O-acetyl-beta-d-glucopyranosid)uronate. Isopentyl glucuronide, PFP. Butyl glucuronide, acetate. (S)-2-Methylbutyl glucuronide, acetate. Propyl glucuronide, acetate. Ethyl glucuronide, acetate.

Find more compounds similar to Isopentyl glucuronide, methyl ester, triacetate.

Sources

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