Chemical Properties of Phenanthrene, 1,2,3,4-tetrahydro- (CAS 1013-08-7)

InChI

InChI=1S/C14H14/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1,3,5,7,9-10H,2,4,6,8H2

InChI Key

UXNCDAQNSQBHEN-UHFFFAOYSA-N

Formula

C14H14

SMILES

c1ccc2c3c(ccc2c1)CCCC3

Molecular Weight¹

182.26

CAS

1013-08-7

Other Names

• 1,2,3,4-Tetrahydrophenanthrene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase 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_fusH : Enthalpy of fusion at a given temperature (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.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	323.16	kJ/mol	Joback Calculated Property
ΔfH°gas	92.30 ± 1.30	kJ/mol	NIST
ΔfusH°	17.26	kJ/mol	Joback Calculated Property
ΔvapH°	52.39	kJ/mol	Joback Calculated Property
log10WS	-4.78		Crippen Calculated Property
logPoct/wat	3.719		Crippen Calculated Property
McVol	154.040	ml/mol	McGowan Calculated Property
Pc	2992.59	kPa	Joback Calculated Property
Inp	[296.00; 1772.00]
Inp	1737.60		NIST
Inp	1755.20		NIST
Inp	1767.70		NIST
Inp	1737.60		NIST
Inp	1755.20		NIST
Inp	1767.70		NIST
Inp	1772.00		NIST
Inp	297.21		NIST
Inp	296.00		NIST
Inp	297.21		NIST
Inp	1772.00		NIST
Inp	1737.60		NIST
Inp	1767.70		NIST
S°liquid	286.60	J/mol×K	NIST
Tboil	591.02	K	Joback Calculated Property
Tc	839.70	K	Joback Calculated Property
Tfus	350.36	K	Joback Calculated Property
Ttriple	[302.55; 302.56]	K
Ttriple	302.55 ± 0.01	K	NIST
Ttriple	302.56 ± 0.01	K	NIST
Vc	0.584	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[374.79; 461.46]	J/mol×K	[591.02; 839.70]
Cp,gas	374.79	J/mol×K	591.02	Joback Calculated Property
Cp,gas	392.34	J/mol×K	632.47	Joback Calculated Property
Cp,gas	408.48	J/mol×K	673.91	Joback Calculated Property
Cp,gas	423.32	J/mol×K	715.36	Joback Calculated Property
Cp,gas	437.01	J/mol×K	756.81	Joback Calculated Property
Cp,gas	449.68	J/mol×K	798.26	Joback Calculated Property
Cp,gas	461.46	J/mol×K	839.70	Joback Calculated Property
Cp,liquid	278.26	J/mol×K	298.15	NIST
η	[0.0004484; 0.0018238]	Pa×s	[350.36; 591.02]
η	0.0018238	Pa×s	350.36	Joback Calculated Property
η	0.0012802	Pa×s	390.47	Joback Calculated Property
η	0.0009598	Pa×s	430.58	Joback Calculated Property
η	0.0007558	Pa×s	470.69	Joback Calculated Property
η	0.0006180	Pa×s	510.80	Joback Calculated Property
η	0.0005203	Pa×s	550.91	Joback Calculated Property
η	0.0004484	Pa×s	591.02	Joback Calculated Property
ΔfusH	[1.77; 11.17]	kJ/mol	[285.00; 302.60]
ΔfusH	5.83	kJ/mol	285.00	NIST
ΔfusH	1.77	kJ/mol	298.00	NIST
ΔfusH	11.17	kJ/mol	302.60	NIST
ΔfusS	[5.92; 36.91]	J/mol×K	[285.00; 302.60]
ΔfusS	20.44	J/mol×K	285.00	NIST
ΔfusS	5.92	J/mol×K	298.00	NIST
ΔfusS	36.91	J/mol×K	302.60	NIST

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Phenanthrene, 1,2,3,4-tetrahydro-.

Sources

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

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