Chemical Properties of 3-Bromo-2-hydroxy-5-nitrobenzaldehyde (CAS 16789-84-7)

InChI

InChI=1S/C7H4BrNO4/c8-6-2-5(9(12)13)1-4(3-10)7(6)11/h1-3,11H

InChI Key

BESBCGANGAEHPM-UHFFFAOYSA-N

Formula

C7H4BrNO4

SMILES

O=Cc1cc([N+](=O)[O-])cc(Br)c1O

Molecular Weight¹

246.01

CAS

16789-84-7

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[290.26; 326.27]	J/mol×K	[743.48; 1014.70]
Cp,gas	290.26	J/mol×K	743.48	Joback Calculated Property
Cp,gas	296.88	J/mol×K	788.68	Joback Calculated Property
Cp,gas	303.09	J/mol×K	833.89	Joback Calculated Property
Cp,gas	308.99	J/mol×K	879.09	Joback Calculated Property
Cp,gas	314.74	J/mol×K	924.30	Joback Calculated Property
Cp,gas	320.46	J/mol×K	969.50	Joback Calculated Property
Cp,gas	326.27	J/mol×K	1014.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Bromo-2-hydroxy-5-nitrobenzaldehyde.

Sources

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

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