Chemical Properties of allo-threonine, trifluoroacetyl-isopropyl ester

allo-threonine, trifluoroacetyl-isopropyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C11H13F6NO5/c1-4(2)22-7(19)6(18-8(20)10(12,13)14)5(3)23-9(21)11(15,16)17/h4-6H,1-3H3,(H,18,20)/t5-,6+/m0/s1
InChI Key
BQCCNVGQXRSHIG-NTSWFWBYSA-N
Formula
C11H13F6NO5
SMILES
CC(C)OC(=O)C(NC(=O)C(F)(F)F)C(C)OC(=O)C(F)(F)F
Molecular Weight1
353.21
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfG° -1636.13 kJ/mol Joback Calculated Property
ΔfH°gas -2029.08 kJ/mol Joback Calculated Property
ΔfusH° 29.60 kJ/mol Joback Calculated Property
ΔvapH° 62.92 kJ/mol Joback Calculated Property
log10WS -2.78 Crippen Calculated Property
logPoct/wat 1.479 Crippen Calculated Property
McVol 202.900 ml/mol McGowan Calculated Property
Pc 1867.55 kPa Joback Calculated Property
Inp 1203.00 NIST
Tboil 695.54 K Joback Calculated Property
Tc 870.65 K Joback Calculated Property
Tfus 424.02 K Joback Calculated Property
Vc 0.808 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [591.62; 647.63] J/mol×K [695.54; 870.65] Show Hide
Cp,gas 591.62 J/mol×K 695.54 Joback Calculated Property
Cp,gas 602.69 J/mol×K 724.72 Joback Calculated Property
Cp,gas 613.04 J/mol×K 753.91 Joback Calculated Property
Cp,gas 622.68 J/mol×K 783.09 Joback Calculated Property
Cp,gas 631.64 J/mol×K 812.28 Joback Calculated Property
Cp,gas 639.95 J/mol×K 841.46 Joback Calculated Property
Cp,gas 647.63 J/mol×K 870.65 Joback Calculated Property

Similar Compounds

threonine, trifluoroacetyl-isopropyl ester. L-Threonine, N,O-di(trifluoroacetyl)-, 2,2,3,3,3-pentafluoropropyl ester. L-Threonine, N-(trifluoroacetyl)-, butyl ester. L-Threonine, N-(trifluoroacetyl)-, trimethylsilyl ester, trifluoroacetate (ester). hydroxyaspartic acid, trifluoroacetyl-isopropyl ester. N-Acetylnorloline. Lincomycin. 4H,6h-m-dioxino[4',5':5,6]pyrano[4,3-d]-4-oxazolin-2-one, hexahydro-4-methoxy-1,8-diphenyl-. «beta»-tiglyl-trachelanthamine, TMS. «beta»-angelyl-trachelanthamine, TMS. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Zinc octaethylporphyrin chloride. Retroisosensine. 5-Hydroxy-tetraline-cis-2,3-diol, ferrocenylboronate. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester.

Find more compounds similar to allo-threonine, trifluoroacetyl-isopropyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.