Chemical Properties of 1,3,5-Triazine, hexahydro-1,3,5-trimethyl- (CAS 108-74-7)

InChI

InChI=1S/C6H15N3/c1-7-4-8(2)6-9(3)5-7/h4-6H2,1-3H3

InChI Key

DPMZXMBOYHBELT-UHFFFAOYSA-N

Formula

C6H15N3

SMILES

CN1CN(C)CN(C)C1

Molecular Weight¹

129.20

CAS

108-74-7

Other Names

• s-Triazine, hexahydro-1,3,5-trimethyl-
• F 7771
• Hexahydro-1,3,5-Trimethyl-s-triazine
• 1,3,5-Trimethylhexahydro-s-triazine
• 1,3,5-Trimethylhexahydro-1,3,5-triazine
• 1,3,5-Trimethylhexahydro-sym-triazine
• hexahydro-1,3,5-trimethyl-1,3,5-triazine

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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_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
ω	0.3893		Relay (... Calculated Property
ΔfG°	273.63	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	76.97	kJ/mol	Relay (... Calculated Property
ΔvapH°	51.20 ± 0.80	kJ/mol	NIST
IE	[7.60; 8.33]	eV
IE	7.60	eV	NIST
IE	7.60	eV	NIST
IE	7.60	eV	NIST
IE	8.26	eV	NIST
IE	8.33 ± 0.05	eV	NIST
log10WS	0.32		Relay (... Calculated Property
logPoct/wat	-0.332		Crippen Calculated Property
McVol	114.480	ml/mol	McGowan Calculated Property
Pc	3425.50	kPa	Relay (... Calculated Property ⚠️
Tboil	436.00	K	NIST
Tc	595.07	K	Relay (... Calculated Property
Tfus	269.99	K	Relay (... Calculated Property
Vc	0.437	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 1,3,5-Triazine, hexahydro-1,3,5-trimethyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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