Chemical Properties of Piperidine, 2,6-dimethyl-, (2R,6S)-rel- (CAS 766-17-6)

InChI

InChI=1S/C7H15N/c1-6-4-3-5-7(2)8-6/h6-8H,3-5H2,1-2H3/t6-,7+

InChI Key

SDGKUVSVPIIUCF-KNVOCYPGSA-N

Formula

C7H15N

SMILES

CC1CCCC(C)N1

Molecular Weight¹

113.20

CAS

766-17-6

Other Names

• Cis- 2,6-Dimethylpiperidine
• 2,6-Dimethylpiperidine

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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°	112.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-116.02	kJ/mol	Joback Calculated Property
ΔfusH°	16.38	kJ/mol	Joback Calculated Property
ΔvapH°	[41.30; 42.40]	kJ/mol
ΔvapH°	41.30 ± 0.10	kJ/mol	NIST
ΔvapH°	42.40 ± 0.60	kJ/mol	NIST
IE	7.93 ± 0.05	eV	NIST
log10WS	-2.06		Crippen Calculated Property
logPoct/wat	1.537		Crippen Calculated Property
McVol	108.610	ml/mol	McGowan Calculated Property
Pc	3488.88	kPa	Joback Calculated Property
Tboil	422.99	K	Joback Calculated Property
Tc	634.06	K	Joback Calculated Property
Tfus	276.82	K	Joback Calculated Property
Vc	0.397	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[215.41; 305.78]	J/mol×K	[422.99; 634.06]
Cp,gas	215.41	J/mol×K	422.99	Joback Calculated Property
Cp,gas	232.27	J/mol×K	458.17	Joback Calculated Property
Cp,gas	248.40	J/mol×K	493.35	Joback Calculated Property
Cp,gas	263.82	J/mol×K	528.52	Joback Calculated Property
Cp,gas	278.51	J/mol×K	563.70	Joback Calculated Property
Cp,gas	292.50	J/mol×K	598.88	Joback Calculated Property
Cp,gas	305.78	J/mol×K	634.06	Joback Calculated Property
ΔvapH	39.70 ± 0.10	kJ/mol	330.00	NIST

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Piperidine, 2,6-dimethyl-, (2R,6S)-rel-.

Sources

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

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