Chemical Properties of Furaneol, «beta»-D-glucopyranoside, TFA

Furaneol, «beta»-D-glucopyranoside, TFA

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InChI
InChI=1S/C20H14F12O12/c1-4-7(33)8(5(2)39-4)41-12-11(44-16(37)20(30,31)32)10(43-15(36)19(27,28)29)9(42-14(35)18(24,25)26)6(40-12)3-38-13(34)17(21,22)23/h4,6,9-12H,3H2,1-2H3/t4?,6-,9-,10+,11-,12+/m0/s1
InChI Key
RTCLBMVJHDXPSV-MFLTXKOCSA-N
Formula
C20H14F12O12
SMILES
CC1=C(OC2OC(COC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C2OC(=O)C(F)(F)F)C(=O)C(C)O1
Molecular Weight1
674.30
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Physical Properties

Property Value Unit Source
Δf -3503.49 kJ/mol Joback Calculated Property
Δfgas -4289.29 kJ/mol Joback Calculated Property
Δfus 73.16 kJ/mol Joback Calculated Property
Δvap 98.49 kJ/mol Joback Calculated Property
log10WS -4.64 Crippen Calculated Property
logPoct/wat 2.475 Crippen Calculated Property
McVol 336.820 ml/mol McGowan Calculated Property
Pc 1002.08 kPa Joback Calculated Property
Inp [1668.00; 1672.00]   Show Hide
Inp 1668.00 NIST
Inp 1672.00 NIST
Inp 1672.00 NIST
Tboil 1109.89 K Joback Calculated Property
Tc 1379.40 K Joback Calculated Property
Tfus 791.27 K Joback Calculated Property
Vc 1.347 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1165.56; 1204.73] J/mol×K [1109.89; 1379.40] Show Hide
Cp,gas 1203.23 J/mol×K 1109.89 Joback Calculated Property
Cp,gas 1204.73 J/mol×K 1154.81 Joback Calculated Property
Cp,gas 1203.09 J/mol×K 1199.73 Joback Calculated Property
Cp,gas 1198.34 J/mol×K 1244.64 Joback Calculated Property
Cp,gas 1190.49 J/mol×K 1289.56 Joback Calculated Property
Cp,gas 1179.55 J/mol×K 1334.48 Joback Calculated Property
Cp,gas 1165.56 J/mol×K 1379.40 Joback Calculated Property

Similar Compounds

Vomifoliol 2A, Gly, TFA. Vomifoliol 1A, Gly, TFA. azadirachtin. 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. Ergocristine. Codeine-propionyl. Galantamin.

Find more compounds similar to Furaneol, «beta»-D-glucopyranoside, TFA.

Sources

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