Chemical Properties of cis-Chrysanthenyl formate (CAS 241123-18-2)

InChI

InChI=1S/C11H16O2/c1-7-4-5-8-10(13-6-12)9(7)11(8,2)3/h4,6,8-10H,5H2,1-3H3

InChI Key

UUPONGFJZWADRE-UHFFFAOYSA-N

Formula

C11H16O2

SMILES

CC1=CCC2C(OC=O)C1C2(C)C

Molecular Weight¹

180.24

CAS

241123-18-2

• 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	0.3825		Relay (... Calculated Property
ΔfG°	-53.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-307.94	kJ/mol	Relay (... Calculated Property
ΔfusH°	18.57	kJ/mol	Joback Calculated Property
ΔvapH°	63.29	kJ/mol	Relay (... Calculated Property
IE	8.91	eV	Relay (... Calculated Property
log10WS	-3.01		Relay (... Calculated Property
logPoct/wat	2.150		Crippen Calculated Property
McVol	147.270	ml/mol	McGowan Calculated Property
Pc	2679.08	kPa	Joback Calculated Property
Inp	[1177.00; 1190.30]
Inp	1177.00		NIST
Inp	1190.30		NIST
Inp	1190.30		NIST
Inp	1177.00		NIST
Tboil	490.18	K	Relay (... Calculated Property
Tc	726.36	K	Relay (... Calculated Property
Tfus	293.89	K	Relay (... Calculated Property
Vc	0.479	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[372.07; 457.74]	J/mol×K	[534.95; 743.67]
Cp,gas	372.07	J/mol×K	534.95	Joback Calculated Property
Cp,gas	388.51	J/mol×K	569.74	Joback Calculated Property
Cp,gas	403.93	J/mol×K	604.52	Joback Calculated Property
Cp,gas	418.45	J/mol×K	639.31	Joback Calculated Property
Cp,gas	432.18	J/mol×K	674.10	Joback Calculated Property
Cp,gas	445.24	J/mol×K	708.88	Joback Calculated Property
Cp,gas	457.74	J/mol×K	743.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to cis-Chrysanthenyl formate.

Sources

• Cheméo Relay (1.0)
• 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.