Chemical Properties of trans-Anthracene, 1,2-dihydro-1,2-diol, diacetate

InChI

InChI=1S/C18H16O4/c1-11(19)21-17-8-7-15-9-13-5-3-4-6-14(13)10-16(15)18(17)22-12(2)20/h3-10,17-18H,1-2H3/t17-,18-/m0/s1

InChI Key

HBOIFXCAOYNEKU-ROUUACIJSA-N

Formula

C18H16O4

SMILES

CC(=O)OC1C=Cc2cc3ccccc3cc2C1OC(C)=O

Molecular Weight¹

296.32

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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.
• 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°	-96.46	kJ/mol	Joback Calculated Property
ΔfH°gas	-395.71	kJ/mol	Joback Calculated Property
ΔfusH°	36.56	kJ/mol	Joback Calculated Property
ΔvapH°	79.28	kJ/mol	Joback Calculated Property
log10WS	-4.77		Crippen Calculated Property
logPoct/wat	3.402		Crippen Calculated Property
McVol	220.980	ml/mol	McGowan Calculated Property
Pc	2163.33	kPa	Joback Calculated Property
Inp	[2255.00; 2255.00]
Inp	2255.00		NIST
Inp	2255.00		NIST
Tboil	824.94	K	Joback Calculated Property
Tc	1060.61	K	Joback Calculated Property
Tfus	532.04	K	Joback Calculated Property
Vc	0.840	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[650.46; 718.58]	J/mol×K	[824.94; 1060.61]
Cp,gas	650.46	J/mol×K	824.94	Joback Calculated Property
Cp,gas	664.49	J/mol×K	864.22	Joback Calculated Property
Cp,gas	677.37	J/mol×K	903.50	Joback Calculated Property
Cp,gas	689.15	J/mol×K	942.77	Joback Calculated Property
Cp,gas	699.90	J/mol×K	982.05	Joback Calculated Property
Cp,gas	709.69	J/mol×K	1021.33	Joback Calculated Property
Cp,gas	718.58	J/mol×K	1060.61	Joback Calculated Property
η	[0.0004137; 0.0013120]	Pa×s	[532.04; 824.94]
η	0.0013120	Pa×s	532.04	Joback Calculated Property
η	0.0009984	Pa×s	580.86	Joback Calculated Property
η	0.0007926	Pa×s	629.67	Joback Calculated Property
η	0.0006505	Pa×s	678.49	Joback Calculated Property
η	0.0005482	Pa×s	727.31	Joback Calculated Property
η	0.0004720	Pa×s	776.12	Joback Calculated Property
η	0.0004137	Pa×s	824.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Anthracene, 1,2-dihydro-1,2-diol, diacetate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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