Chemical Properties of 7-Methyl-1,5-diazacyclotetradecane

InChI

InChI=1S/C13H28N2/c1-13-8-5-3-2-4-6-9-14-10-7-11-15-12-13/h13-15H,2-12H2,1H3

InChI Key

OFPMSWKVQNUTSL-UHFFFAOYSA-N

Formula

C13H28N2

SMILES

CC1CCCCCCCNCCCNC1

Molecular Weight¹

212.37

Other Names

• (S)-7-methyl-1,5-diazacyclotetradecane (S-(-)-haliclorensin)

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	161.65	kJ/mol	Joback Calculated Property
ΔfH°gas	-230.99	kJ/mol	Joback Calculated Property
ΔfusH°	23.64	kJ/mol	Joback Calculated Property
ΔvapH°	59.85	kJ/mol	Joback Calculated Property
log10WS	-3.30		Crippen Calculated Property
logPoct/wat	2.546		Crippen Calculated Property
McVol	203.130	ml/mol	McGowan Calculated Property
Pc	2472.73	kPa	Joback Calculated Property
Inp	[1711.00; 1711.00]
Inp	1711.00		NIST
Inp	1711.00		NIST
Tboil	647.65	K	Joback Calculated Property
Tc	906.72	K	Joback Calculated Property
Tfus	425.55	K	Joback Calculated Property
Vc	0.707	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[577.29; 721.52]	J/mol×K	[647.65; 906.72]
Cp,gas	577.29	J/mol×K	647.65	Joback Calculated Property
Cp,gas	607.04	J/mol×K	690.83	Joback Calculated Property
Cp,gas	634.61	J/mol×K	734.01	Joback Calculated Property
Cp,gas	659.91	J/mol×K	777.18	Joback Calculated Property
Cp,gas	682.88	J/mol×K	820.36	Joback Calculated Property
Cp,gas	703.44	J/mol×K	863.54	Joback Calculated Property
Cp,gas	721.52	J/mol×K	906.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to 7-Methyl-1,5-diazacyclotetradecane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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