Chemical Properties of tert-Butyl N-(1-hydroxy-2,2,2-trifluoroethyl)carbamate (CAS 17049-74-0)

tert-Butyl N-(1-hydroxy-2,2,2-trifluoroethyl)carbamate

InChI
InChI=1S/C7H12F3NO3/c1-6(2,3)14-5(13)11-4(12)7(8,9)10/h4,12H,1-3H3,(H,11,13)
InChI Key
HVTJYNRKBXOBCX-UHFFFAOYSA-N
Formula
C7H12F3NO3
SMILES
CC(C)(C)OC(=O)NC(O)C(F)(F)F
Molecular Weight1
215.17
CAS
17049-74-0
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Physical Properties

Property Value Unit Source
ΔfH°gas -1356.97 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 18.33 kJ/mol Joback Calculated Property
ΔvapH° 77.72 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 1.392 Crippen Calculated Property
McVol 138.090 ml/mol McGowan Calculated Property
Tboil 450.90 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [363.02; 416.58] J/mol×K [551.24; 719.63] Show Hide
Cp,gas 363.02 J/mol×K 551.24 Joback Calculated Property
Cp,gas 373.43 J/mol×K 579.31 Joback Calculated Property
Cp,gas 383.21 J/mol×K 607.37 Joback Calculated Property
Cp,gas 392.39 J/mol×K 635.44 Joback Calculated Property
Cp,gas 400.99 J/mol×K 663.50 Joback Calculated Property
Cp,gas 409.05 J/mol×K 691.57 Joback Calculated Property
Cp,gas 416.58 J/mol×K 719.63 Joback Calculated Property

Similar Compounds

N-(tert-Butoxycarbonyl)glycine, methyl ester. boc-glycine. 2,3-Diaminopropionic acid, ethoxycarbonylated, TBDMS. N-Methyl-1-deoxynojirimycin, tetrakis(trifluoroacetate). Propafenone desamino dihydroxy, acetylated. Homoserine, ethoxycarbonylated, TBDMS. Homocysteine, ethoxycarbonylated, TBDMS. Homophenylalanine, ethoxycarbonylated, TBDMS. «beta»-Aminoisobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. Isoleucine, ethoxycarbonylated, TBDMS. Prothipendyl M (bis-nor-), monoacetylated. Isonipecotic acid, N-(4-butylbenzoyl)-, octyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, decyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, nonyl ester. (.+/-.)-Platydesmine.

Find more compounds similar to tert-Butyl N-(1-hydroxy-2,2,2-trifluoroethyl)carbamate.

Sources

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