Chemical Properties of Phenanthrene, tetradecahydro- (CAS 5743-97-5)

InChI

InChI=1S/C14H24/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h11-14H,1-10H2

InChI Key

GNMCGMFNBARSIY-UHFFFAOYSA-N

Formula

C14H24

SMILES

C1CCC2C(C1)CCC1CCCCC12

Molecular Weight¹

192.34

CAS

5743-97-5

Other Names

• Perhydrophenanthrene
• Perhydrophenanthrene, # 1
• Perhydrophenanthrene, # 2
• Perhydrophenanthrene, # 3
• Perhydrophenanthrene, # 4
• Perhydrophenanthrene, # 6
• Perhydrophenanthrene, # 7
• Perhydrophenanthrene, # 8
• Perhydrophenanthrene, # 9
• Perhydrophenanthrene, % 5
• Tetradecahydrophenanthrene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• C_p,solid : Solid 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• 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°	181.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-165.03	kJ/mol	Joback Calculated Property
ΔfusH°	16.99	kJ/mol	Joback Calculated Property
ΔvapH°	47.05	kJ/mol	Joback Calculated Property
log10WS	-4.40		Crippen Calculated Property
logPoct/wat	4.393		Crippen Calculated Property
McVol	175.540	ml/mol	McGowan Calculated Property
Pc	2311.39	kPa	Joback Calculated Property
Inp	[1509.00; 1581.00]
Inp	1514.00		NIST
Inp	1519.00		NIST
Inp	1514.00		NIST
Inp	1539.00		NIST
Inp	1517.00		NIST
Inp	1539.00		NIST
Inp	1566.00		NIST
Inp	1534.00		NIST
Inp	1554.00		NIST
Inp	1578.00		NIST
Inp	1560.00		NIST
Inp	1581.00		NIST
Inp	1510.00		NIST
Inp	1528.00		NIST
Inp	1509.00		NIST
Inp	1528.00		NIST
Inp	1556.00		NIST
Inp	1559.00		NIST
Inp	1581.00		NIST
Inp	1543.00		NIST
Inp	1567.00		NIST
Tboil	556.62	K	Joback Calculated Property
Tc	789.03	K	Joback Calculated Property
Tfus	279.52	K	Joback Calculated Property
Vc	0.649	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[476.02; 614.30]	J/mol×K	[556.62; 789.03]
Cp,gas	476.02	J/mol×K	556.62	Joback Calculated Property
Cp,gas	503.38	J/mol×K	595.35	Joback Calculated Property
Cp,gas	528.90	J/mol×K	634.09	Joback Calculated Property
Cp,gas	552.65	J/mol×K	672.82	Joback Calculated Property
Cp,gas	574.73	J/mol×K	711.56	Joback Calculated Property
Cp,gas	595.25	J/mol×K	750.29	Joback Calculated Property
Cp,gas	614.30	J/mol×K	789.03	Joback Calculated Property
Cp,liquid	330.10	J/mol×K	313.00	NIST
Cp,solid	[281.20; 345.60]	J/mol×K	[298.00; 298.00]
Cp,solid	289.50	J/mol×K	298.00	NIST
Cp,solid	345.60	J/mol×K	298.00	NIST
Cp,solid	281.20	J/mol×K	298.00	NIST
η	[0.0006747; 0.0033535]	Pa×s	[279.52; 556.62]
η	0.0033535	Pa×s	279.52	Joback Calculated Property
η	0.0021240	Pa×s	325.70	Joback Calculated Property
η	0.0015068	Pa×s	371.89	Joback Calculated Property
η	0.0011532	Pa×s	418.07	Joback Calculated Property
η	0.0009308	Pa×s	464.25	Joback Calculated Property
η	0.0007810	Pa×s	510.44	Joback Calculated Property
η	0.0006747	Pa×s	556.62	Joback Calculated Property
ΔfusH	[10.48; 11.83]	kJ/mol	[273.00; 313.00]
ΔfusH	10.48	kJ/mol	273.00	NIST
ΔfusH	11.83	kJ/mol	283.00	NIST
ΔfusH	11.15	kJ/mol	313.00	NIST
ΔvapH	55.70	kJ/mol	503.00	NIST
ΔfusS	[35.64; 41.81]	J/mol×K	[273.00; 313.00]
ΔfusS	38.39	J/mol×K	273.00	NIST
ΔfusS	41.81	J/mol×K	283.00	NIST
ΔfusS	35.64	J/mol×K	313.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[368.53; 612.91]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			8.03900e+00
Coefficient B			-1.02843e+03
Coefficient C			-2.35850e+02
Temperature range, min.			368.53
Temperature range, max.			612.91
Pvap	1.33	kPa	368.53	Calculated Property
Pvap	4.98	kPa	395.68	Calculated Property
Pvap	12.67	kPa	422.84	Calculated Property
Pvap	25.44	kPa	449.99	Calculated Property
Pvap	43.68	kPa	477.14	Calculated Property
Pvap	67.22	kPa	504.30	Calculated Property
Pvap	95.57	kPa	531.45	Calculated Property
Pvap	128.07	kPa	558.60	Calculated Property
Pvap	164.00	kPa	585.76	Calculated Property
Pvap	202.66	kPa	612.91	Calculated Property

Similar Compounds

Find more compounds similar to Phenanthrene, tetradecahydro-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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