Chemical Properties of 3,5-Dimethoxy-4-hydroxybenzhydrazide

InChI

InChI=1S/C9H12N2O4/c1-14-6-3-5(9(13)11-10)4-7(15-2)8(6)12/h3-4,12H,10H2,1-2H3,(H,11,13)

InChI Key

AKZAAANGIPRVDU-UHFFFAOYSA-N

Formula

C9H12N2O4

SMILES

COc1cc(C(=O)NN)cc(OC)c1O

Molecular Weight¹

212.21

Other Names

• 4-hydroxy-3,5-dimethoxybenzoic acid
• Benzoic acid, 4-hydroxy-3,5-dimethoxy-, hydrazide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	32.38	kJ/mol	Joback Calculated Property
log10WS	-1.32		Relay (1.0) Calculated Property
logPoct/wat	0.013		Crippen Calculated Property
McVol	153.050	ml/mol	McGowan Calculated Property
Inp	[1773.50; 1777.00]
Inp	1773.50		NIST
Inp	1777.00		NIST
Inp	1777.00		NIST
Inp	1773.50		NIST
Tboil	611.94	K	Relay (1.0) Calculated Property
Tfus	429.15	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[229.43; 480.34]	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			4.41200e+01
Coefficient B			7.99240e-01
Coefficient C			-4.70580e-04
Coefficient D			1.07560e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	229.43	J/mol×K	273.00	Calculated Property
Cp,gas	272.74	J/mol×K	353.78	Calculated Property
Cp,gas	311.40	J/mol×K	434.56	Calculated Property
Cp,gas	345.74	J/mol×K	515.33	Calculated Property
Cp,gas	376.12	J/mol×K	596.11	Calculated Property
Cp,gas	402.87	J/mol×K	676.89	Calculated Property
Cp,gas	426.32	J/mol×K	757.67	Calculated Property
Cp,gas	446.82	J/mol×K	838.44	Calculated Property
Cp,gas	464.72	J/mol×K	919.22	Calculated Property
Cp,gas	480.34	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 3,5-Dimethoxy-4-hydroxybenzhydrazide.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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