Chemical Properties of 2,3-Naphthalenediol

InChI

InChI=1S/C10H8O2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6,11-12H

InChI Key

JRNGUTKWMSBIBF-UHFFFAOYSA-N

Formula

C10H8O2

SMILES

Oc1cc2ccccc2cc1O

Molecular Weight¹

160.17

Other Names

• Naphthalene-2,3-diol
• 2,3-Dihydroxynapthalene
• 2,3-Dihydroxynaphthalene
• Naphthalenediol-(2,3)

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• 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_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (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).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (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
ω	0.6793		Relay (1.0) Calculated Property
ΔcH°solid	[-4776.00; -4761.97]	kJ/mol
ΔcH°solid	-4776.00 ± 1.10	kJ/mol	NIST
ΔcH°solid	-4761.97 ± 0.67	kJ/mol	NIST
ΔfG°	-56.86	kJ/mol	Joback Calculated Property
ΔfH°gas	[-207.00; -192.80]	kJ/mol
ΔfH°gas	-192.80 ± 2.00	kJ/mol	NIST
ΔfH°gas	-207.00 ± 1.60	kJ/mol	NIST
ΔfH°solid	[-316.40; -302.40]	kJ/mol
ΔfH°solid	-302.40 ± 1.70	kJ/mol	NIST
ΔfH°solid	-316.40 ± 1.50	kJ/mol	NIST
ΔfusH°	24.28	kJ/mol	Joback Calculated Property
ΔsubH°	[109.40; 109.60]	kJ/mol
ΔsubH°	109.60 ± 1.00	kJ/mol	NIST
ΔsubH°	109.60	kJ/mol	NIST
ΔsubH°	109.60 ± 1.00	kJ/mol	NIST
ΔsubH°	109.40 ± 0.50	kJ/mol	NIST
ΔsubH°	109.40	kJ/mol	NIST
ΔvapH°	104.67	kJ/mol	Relay (1.0) Calculated Property
IE	7.69	eV	Relay (1.0) Calculated Property
log10WS	-2.35		Relay (1.0) Calculated Property
logPoct/wat	2.251		Crippen Calculated Property
McVol	120.280	ml/mol	McGowan Calculated Property
Pc	5880.91	kPa	Joback Calculated Property
S°solid,1 bar	192.00	J/mol×K	NIST
Tboil	588.67	K	Relay (1.0) Calculated Property
Tc	879.84	K	Relay (1.0) Calculated Property
Tfus	481.03	K	Relay (1.0) Calculated Property
Vc	0.404	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[153.14; 370.77]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-8.93900e+01
Coefficient B			1.18040e+00
Coefficient C			-1.20084e-03
Coefficient D			4.80600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	153.14	J/mol×K	273.00	Calculated Property
Cp,gas	199.19	J/mol×K	353.78	Calculated Property
Cp,gas	236.23	J/mol×K	434.56	Calculated Property
Cp,gas	265.78	J/mol×K	515.33	Calculated Property
Cp,gas	289.35	J/mol×K	596.11	Calculated Property
Cp,gas	308.46	J/mol×K	676.89	Calculated Property
Cp,gas	324.64	J/mol×K	757.67	Calculated Property
Cp,gas	339.41	J/mol×K	838.44	Calculated Property
Cp,gas	354.28	J/mol×K	919.22	Calculated Property
Cp,gas	370.77	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001338; 0.0000081]	Pa×s	[485.02; 627.10]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-2.13178e+01
Coefficient B			6.01346e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			485.02
Temperature range, max.			627.10
η	0.0001338	Pa×s	485.02	Calculated Property
η	0.0000905	Pa×s	500.81	Calculated Property
η	0.0000627	Pa×s	516.59	Calculated Property
η	0.0000444	Pa×s	532.38	Calculated Property
η	0.0000321	Pa×s	548.17	Calculated Property
η	0.0000236	Pa×s	563.95	Calculated Property
η	0.0000176	Pa×s	579.74	Calculated Property
η	0.0000134	Pa×s	595.52	Calculated Property
η	0.0000103	Pa×s	611.31	Calculated Property
η	0.0000081	Pa×s	627.10	Calculated Property

Similar Compounds

Find more compounds similar to 2,3-Naphthalenediol.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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