Chemical Properties of Y-Curcumenal

InChI

InChI=1S/C15H20O/c1-12-7-9-15(10-8-12)14(3)6-4-5-13(2)11-16/h4-5,7-11,13-14H,6H2,1-3H3/b5-4+

InChI Key

STQHHYPRNPVXTF-SNAWJCMRSA-N

Formula

C15H20O

SMILES

Cc1ccc(C(C)CC=CC(C)C=O)cc1

Molecular Weight¹

216.32

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	23.70	kJ/mol	Joback Calculated Property
IE	8.30	eV	Relay (1.0) Calculated Property
logPoct/wat	3.880		Crippen Calculated Property
McVol	195.720	ml/mol	McGowan Calculated Property
Inp	[1742.00; 1742.00]
Inp	1742.00		NIST
Inp	1742.00		NIST
Tboil	555.50	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[498.52; 585.51]	J/mol×K	[626.40; 838.08]
Cp,gas	498.52	J/mol×K	626.40	Joback Calculated Property
Cp,gas	515.44	J/mol×K	661.68	Joback Calculated Property
Cp,gas	531.31	J/mol×K	696.96	Joback Calculated Property
Cp,gas	546.20	J/mol×K	732.24	Joback Calculated Property
Cp,gas	560.16	J/mol×K	767.52	Joback Calculated Property
Cp,gas	573.24	J/mol×K	802.80	Joback Calculated Property
Cp,gas	585.51	J/mol×K	838.08	Joback Calculated Property
η	[0.0001397; 0.0037370]	Pa×s	[304.67; 626.40]
η	0.0037370	Pa×s	304.67	Joback Calculated Property
η	0.0014343	Pa×s	358.29	Joback Calculated Property
η	0.0007063	Pa×s	411.91	Joback Calculated Property
η	0.0004095	Pa×s	465.53	Joback Calculated Property
η	0.0002657	Pa×s	519.16	Joback Calculated Property
η	0.0001870	Pa×s	572.78	Joback Calculated Property
η	0.0001397	Pa×s	626.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Y-Curcumenal.

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
• 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.
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