Chemical Properties of «beta»-Microbiotene

InChI

InChI=1S/C15H24/c1-11-6-9-15(10-12(11)15)14(4)8-5-7-13(14,2)3/h12H,1,5-10H2,2-4H3/t12-,14+,15+/m1/s1

InChI Key

YMPBLULPBSVQLP-SNPRPXQTSA-N

Formula

C15H24

SMILES

C=C1CCC2(C3(C)CCCC3(C)C)CC12

Molecular Weight¹

204.35

• ω : Acentric Factor.
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.3342		Relay (... Calculated Property
ΔfG°	262.37	kJ/mol	Joback Calculated Property
ΔfH°gas	41.15	kJ/mol	Relay (... Calculated Property
ΔfusH°	5.83	kJ/mol	Joback Calculated Property
ΔvapH°	61.68	kJ/mol	Relay (... Calculated Property
IE	8.59	eV	Relay (... Calculated Property
log10WS	-5.03		Relay (... Calculated Property
logPoct/wat	4.559		Crippen Calculated Property
McVol	185.330	ml/mol	McGowan Calculated Property
Pc	2274.07	kPa	Joback Calculated Property
Inp	[1471.00; 1473.00]
Inp	1471.00		NIST
Inp	1473.00		NIST
Tboil	527.24	K	Relay (... Calculated Property
Tc	766.36	K	Relay (... Calculated Property
Tfus	375.87	K	Relay (... Calculated Property
Vc	0.657	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[500.14; 619.44]	J/mol×K	[566.57; 800.20]
Cp,gas	500.14	J/mol×K	566.57	Joback Calculated Property
Cp,gas	522.76	J/mol×K	605.51	Joback Calculated Property
Cp,gas	543.69	J/mol×K	644.45	Joback Calculated Property
Cp,gas	563.39	J/mol×K	683.38	Joback Calculated Property
Cp,gas	582.28	J/mol×K	722.32	Joback Calculated Property
Cp,gas	600.82	J/mol×K	761.26	Joback Calculated Property
Cp,gas	619.44	J/mol×K	800.20	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Microbiotene.

Sources

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

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