Chemical Properties of Sarcosine, N-(cyclopentylcarbonyl)-, propyl ester

InChI

InChI=1S/C12H21NO3/c1-3-8-16-11(14)9-13(2)12(15)10-6-4-5-7-10/h10H,3-9H2,1-2H3

InChI Key

ITYUXPFUTILAEO-UHFFFAOYSA-N

Formula

C12H21NO3

SMILES

CCCOC(=O)CN(C)C(=O)C1CCCC1

Molecular Weight¹

227.30

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	29.76	kJ/mol	Joback Calculated Property
ΔvapH°	74.80	kJ/mol	Relay (1.0) Calculated Property
IE	8.59	eV	Relay (1.0) Calculated Property
log10WS	-1.69		Relay (1.0) Calculated Property
logPoct/wat	1.588		Crippen Calculated Property
McVol	188.070	ml/mol	McGowan Calculated Property
Pc	2216.62	kPa	Joback Calculated Property
Inp	[1754.00; 1754.00]
Inp	1754.00		NIST
Inp	1754.00		NIST
Tboil	565.50	K	Relay (1.0) Calculated Property
Tc	764.49	K	Relay (1.0) Calculated Property
Tfus	281.07	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[510.03; 599.87]	J/mol×K	[613.97; 809.93]
Cp,gas	510.03	J/mol×K	613.97	Joback Calculated Property
Cp,gas	527.46	J/mol×K	646.63	Joback Calculated Property
Cp,gas	543.87	J/mol×K	679.29	Joback Calculated Property
Cp,gas	559.29	J/mol×K	711.95	Joback Calculated Property
Cp,gas	573.74	J/mol×K	744.61	Joback Calculated Property
Cp,gas	587.25	J/mol×K	777.27	Joback Calculated Property
Cp,gas	599.87	J/mol×K	809.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(cyclopentylcarbonyl)-, propyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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.
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