Chemical Properties of (S)-(+)-2-(Methoxymethyl)pyrrolidine (CAS 63126-47-6)

(S)-(+)-2-(Methoxymethyl)pyrrolidine

InChI
InChI=1S/C6H13NO/c1-8-5-6-3-2-4-7-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChI Key
CHPRFKYDQRKRRK-ZCFIWIBFSA-N
Formula
C6H13NO
SMILES
COCC1CCCN1
Molecular Weight1
115.17
CAS
63126-47-6
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Physical Properties

Property Value Unit Source
ΔfusH° 16.01 kJ/mol Joback Calculated Property
ΔvapH° 48.62 kJ/mol Relay (1.0) Calculated Property
log10WS 0.33 Relay (1.0) Calculated Property
logPoct/wat 0.385 Crippen Calculated Property
McVol 100.390 ml/mol McGowan Calculated Property
Tboil 426.14 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 335.20 K 5.30 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [132.05; 361.89] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.06290e+01
Coefficient B6.28920e-01
Coefficient C-2.58400e-04
Coefficient D1.20000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 132.05 J/mol×K 273.00 Calculated Property
Cp,gas 170.06 J/mol×K 353.78 Calculated Property
Cp,gas 204.86 J/mol×K 434.56 Calculated Property
Cp,gas 236.49 J/mol×K 515.33 Calculated Property
Cp,gas 265.00 J/mol×K 596.11 Calculated Property
Cp,gas 290.41 J/mol×K 676.89 Calculated Property
Cp,gas 312.77 J/mol×K 757.67 Calculated Property
Cp,gas 332.11 J/mol×K 838.44 Calculated Property
Cp,gas 348.47 J/mol×K 919.22 Calculated Property
Cp,gas 361.89 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Piperidinemethanol. Pro, methyl ester. (S)-(-)-1-AMINO-2-(METHOXYMETHYL)-PYRROLIDINE. (S)-(-)-2-(Methoxymethyl)-1-pyrrolidinecarboxaldehyde. Pro, propyl ester. Pro, isopropyl ester. ETHYL 2-PIPERIDINECARBOXYLATE. 6-Pentanoyloxynortropan-6-ol. 6-Butyroxynortropan-3-ol. Merresectine A. 2-Piperidinecarboxylic acid, trimethylsilyl ester. 2-(2-Hydroxyethyl)piperidine. [2H]Glucitolamine hexaacetate. l-Proline, trimethylsilyl ester. N-Acetyl-D-galactosaminitol, pentakis(trifluoroacetate).

Find more compounds similar to (S)-(+)-2-(Methoxymethyl)pyrrolidine.

Sources

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