Chemical Properties of «beta»-Acoradiene (CAS 28477-64-7)

InChI

InChI=1S/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h7,13-14H,1,5-6,8-10H2,2-4H3/t13-,14+,15+/m0/s1

InChI Key

DVBSKQAFCDJNSL-RRFJBIMHSA-N

Formula

C15H24

SMILES

C=C(C)C1CCC(C)C12CC=C(C)CC2

Molecular Weight¹

204.35

CAS

28477-64-7

• 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.
• I : 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°	234.94	kJ/mol	Joback Calculated Property
ΔfH°gas	-75.12	kJ/mol	Joback Calculated Property
ΔfusH°	15.49	kJ/mol	Joback Calculated Property
ΔvapH°	48.40	kJ/mol	Joback Calculated Property
log10WS	-4.87		Crippen Calculated Property
logPoct/wat	4.725		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Pc	2032.72	kPa	Joback Calculated Property
Inp	[1440.00; 1499.00]
Inp	1478.00		NIST
Inp	1465.00		NIST
Inp	1459.00		NIST
Inp	1466.00		NIST
Inp	1465.00		NIST
Inp	1458.00		NIST
Inp	1463.00		NIST
Inp	1471.00		NIST
Inp	1465.00		NIST
Inp	1466.00		NIST
Inp	1471.00		NIST
Inp	1452.00		NIST
Inp	1473.00		NIST
Inp	1462.00		NIST
Inp	1471.00		NIST
Inp	1475.00		NIST
Inp	1476.00		NIST
Inp	1468.00		NIST
Inp	1482.00		NIST
Inp	1478.00		NIST
Inp	1462.00		NIST
Inp	1455.00		NIST
Inp	1455.00		NIST
Inp	Outlier 1499.00		NIST
Inp	Outlier 1440.00		NIST
Inp	1471.00		NIST
Inp	1475.00		NIST
Inp	1475.00		NIST
Inp	1465.00		NIST
Inp	Outlier 1446.00		NIST
Inp	1469.00		NIST
Inp	1470.00		NIST
Inp	1454.00		NIST
Inp	1472.00		NIST
Inp	1463.00		NIST
Inp	1471.00		NIST
Inp	1464.00		NIST
Inp	1456.00		NIST
Inp	1466.00		NIST
Inp	1465.00		NIST
Inp	1466.00		NIST
Inp	1471.00		NIST
I	[1674.00; 1708.00]
I	1674.00		NIST
I	1674.00		NIST
I	1677.00		NIST
I	1677.00		NIST
I	1708.00		NIST
I	1693.00		NIST
I	1700.00		NIST
I	1693.00		NIST
I	1693.00		NIST
I	1674.00		NIST
I	1677.00		NIST
Tboil	569.43	K	Joback Calculated Property
Tc	794.31	K	Joback Calculated Property
Tfus	297.83	K	Joback Calculated Property
Vc	0.723	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[499.65; 621.57]	J/mol×K	[569.43; 794.31]
Cp,gas	499.65	J/mol×K	569.43	Joback Calculated Property
Cp,gas	523.17	J/mol×K	606.91	Joback Calculated Property
Cp,gas	545.19	J/mol×K	644.39	Joback Calculated Property
Cp,gas	565.88	J/mol×K	681.87	Joback Calculated Property
Cp,gas	585.40	J/mol×K	719.35	Joback Calculated Property
Cp,gas	603.90	J/mol×K	756.83	Joback Calculated Property
Cp,gas	621.57	J/mol×K	794.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Acoradiene.

Sources

• 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.