«beta»-Resorcylic acid (CAS 89-86-1) - Chemical & Physical Properties by Cheméo

InChI

InChI=1S/C7H6O4/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,8-9H,(H,10,11)

InChI Key

UIAFKZKHHVMJGS-UHFFFAOYSA-N

Formula

C7H6O4

SMILES

O=C(O)c1ccc(O)cc1O

Molecular Weight¹

154.12

CAS

89-86-1

Other Names

.beta.-resorcinolic acid
.beta.-resorcylic acid
2,4-Dhba
2,4-dihydroxybenzoic acid
4-carboxyresorcinol
4-hydroxysalicylic acid
BRA
Coupler 320
NSC 13564
Resorcylic acid, «beta»
benzoic acid, 2,4-dihydroxy-
p-hydroxysalicylic acid
«beta»-Resorcinolic acid

ω : Acentric Factor.
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_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).
P_sub : Sublimation 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.

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Physical Properties

Property	Value	Unit	Source
ω	0.8479		Relay (1.0) Calculated Property
Δ_fG°	-454.51	kJ/mol	Joback Calculated Property
Δ_fH°_gas	-661.04	kJ/mol	Relay (1.0) Calculated Property
Δ_fusH°	31.00	kJ/mol	Thermochemical study of 2,4-, 2,6- and 3,4-dihydroxybenzoic acids in the liquid phase using a TG apparatus
Δ_subH°	126.40 ± 0.80	kJ/mol	NIST
Δ_vapH°	110.23	kJ/mol	Relay (1.0) Calculated Property
IE	8.59	eV	Relay (1.0) Calculated Property
log₁₀WS	-1.78		Relay (1.0) Calculated Property
logP_oct/wat	0.796		Crippen Calculated Property
McVol	104.910	ml/mol	McGowan Calculated Property
P_c	8175.04	kPa	Joback Calculated Property
I_np	[1532.00; 1532.00]
I_np	1532.00		NIST
I_np	1532.00		NIST
T_boil	570.17	K	Relay (1.0) Calculated Property
T_c	880.61	K	Relay (1.0) Calculated Property
T_fus	492.00 ± 4.00	K	NIST
V_c	0.359	m³/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
C_p,gas	[267.80; 301.93]	J/mol×K	[693.53; 922.45]

C_p,gas	267.80	J/mol×K	693.53	Joback Calculated Property
C_p,gas	273.90	J/mol×K	731.68	Joback Calculated Property
C_p,gas	279.67	J/mol×K	769.84	Joback Calculated Property
C_p,gas	285.24	J/mol×K	807.99	Joback Calculated Property
C_p,gas	290.73	J/mol×K	846.15	Joback Calculated Property
C_p,gas	296.25	J/mol×K	884.30	Joback Calculated Property
C_p,gas	301.93	J/mol×K	922.45	Joback Calculated Property
η	[0.0000008; 0.0000285]	Pa×s	[529.26; 693.53]

η	0.0000285	Pa×s	529.26	Joback Calculated Property
η	0.0000136	Pa×s	556.64	Joback Calculated Property
η	0.0000069	Pa×s	584.02	Joback Calculated Property
η	0.0000038	Pa×s	611.39	Joback Calculated Property
η	0.0000021	Pa×s	638.77	Joback Calculated Property
η	0.0000013	Pa×s	666.15	Joback Calculated Property
η	0.0000008	Pa×s	693.53	Joback Calculated Property
Δ_subH	124.00 ± 0.80	kJ/mol	384.00	NIST
P_sub	[1.92e-04; 9.88e-04]	kPa	[376.22; 392.11]

P_sub	1.98e-04	kPa	376.22	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	1.92e-04	kPa	376.22	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	1.95e-04	kPa	376.22	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.24e-04	kPa	377.32	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.17e-04	kPa	377.32	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.20e-04	kPa	377.32	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.69e-04	kPa	379.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.60e-04	kPa	379.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	2.64e-04	kPa	379.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.32e-04	kPa	381.15	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.15e-04	kPa	381.15	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.19e-04	kPa	381.15	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.99e-04	kPa	383.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.88e-04	kPa	383.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	3.90e-04	kPa	383.13	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	5.01e-04	kPa	385.12	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	4.89e-04	kPa	385.12	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	4.93e-04	kPa	385.12	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	6.13e-04	kPa	387.17	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	5.91e-04	kPa	387.17	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	5.93e-04	kPa	387.17	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	7.62e-04	kPa	389.35	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	7.32e-04	kPa	389.35	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	7.41e-04	kPa	389.35	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	9.16e-04	kPa	391.30	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	8.84e-04	kPa	391.30	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	8.93e-04	kPa	391.30	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	9.88e-04	kPa	392.11	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	9.61e-04	kPa	392.11	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers
P_sub	9.55e-04	kPa	392.11	Vapor Pressures and Enthalpies of Combustion of the Dihydroxybenzoic Acid Isomers

Similar Compounds

Benzoic acid, 2,4-dihydroxy-, methyl ester.

2-Naphthalenecarboxylic acid, 3-hydroxy-.

Find more compounds similar to «beta»-Resorcylic acid.

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Chemical Properties of «beta»-Resorcylic acid (CAS 89-86-1)

Physical Properties

Temperature Dependent Properties

Similar Compounds

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