Chemical Properties of N-Acetyl-D-galactosaminitol, pentakis(trifluoroacetate)

N-Acetyl-D-galactosaminitol, pentakis(trifluoroacetate)

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InChI
InChI=1S/C18H12F15NO11/c1-4(35)34-5(2-41-9(36)14(19,20)21)7(44-12(39)17(28,29)30)8(45-13(40)18(31,32)33)6(43-11(38)16(25,26)27)3-42-10(37)15(22,23)24/h5-8H,2-3H2,1H3,(H,34,35)
InChI Key
QEVIVUVSMPUBDA-UHFFFAOYSA-N
Formula
C18H12F15NO11
SMILES
CC(=O)NC(COC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(COC(=O)C(F)(F)F)OC(=O)C(F)(F)F
Molecular Weight1
703.26
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Physical Properties

Property Value Unit Source
Δf -4026.16 kJ/mol Joback Calculated Property
Δfgas -4704.48 kJ/mol Joback Calculated Property
Δfus 58.05 kJ/mol Joback Calculated Property
Δvap 94.34 kJ/mol Joback Calculated Property
log10WS -4.39 Crippen Calculated Property
logPoct/wat 2.124 Crippen Calculated Property
McVol 339.780 ml/mol McGowan Calculated Property
Pc 983.93 kPa Joback Calculated Property
Inp [1394.30; 1394.30]   Show Hide
Inp 1394.30 NIST
Inp 1394.30 NIST
Tboil 1067.87 K Joback Calculated Property
Tc 1359.21 K Joback Calculated Property
Tfus 716.96 K Joback Calculated Property
Vc 1.395 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1138.97; 1155.26] J/mol×K [1067.87; 1359.21] Show Hide
Cp,gas 1138.97 J/mol×K 1067.87 Joback Calculated Property
Cp,gas 1145.17 J/mol×K 1116.43 Joback Calculated Property
Cp,gas 1149.68 J/mol×K 1164.98 Joback Calculated Property
Cp,gas 1152.71 J/mol×K 1213.54 Joback Calculated Property
Cp,gas 1154.50 J/mol×K 1262.10 Joback Calculated Property
Cp,gas 1155.26 J/mol×K 1310.65 Joback Calculated Property
Cp,gas 1155.21 J/mol×K 1359.21 Joback Calculated Property

Similar Compounds

[2H]Glucitolamine hexaacetate. N-Acetyl-D-glucosamine, tetrakis(trifluoroacetate), methyloxime (syn). N-Acetyl-D-glucosamine, tetrakis(trifluoroacetate), methyloxime (anti). «beta»-Mannosyl-(1-4)-N-acetylglucosamine, permethyl. N-Acetyl-D-glucosamine, aldononitrile, tetraacetate. Pregnan-2,3,20-triol, GlcNAc, MeTMS. 5-«alpha»-Pregnan-3-«beta»-ol, 20-«alpha»-GlcNAc, MeTMS. Acetic acid 2-acetoxymethyl-5-(acetyl-methyl-amino)-3,6-dimethoxy-tetrahydro-pyran-4-yl ester. Acetic acid 3-acetoxy-2-acetoxymethyl-5-(acetyl-methyl-amino)-6-methoxy-tetrahydro-pyran-4-yl ester. Methyl 4,6-di-O-acetyl-2-deoxy-3-O-methyl-2-(N-methylacetamido)-«alpha»-D-glucopyranoside. amikacin. pimaricin. N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 1). N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether (isomer 2). Acetic acid 5-(acetyl-methyl-amino) -3,4,6-trimethoxy-tetrahydro-pyran- 2-ylmethyl ester.

Find more compounds similar to N-Acetyl-D-galactosaminitol, pentakis(trifluoroacetate).

Sources

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