Chemical Properties of 3-Amino-2,5-dichlorobenzoic acid, N-dimethylaminomethylene-, methyl ester

InChI

InChI=1S/C11H12Cl2N2O2/c1-15(2)6-14-9-5-7(12)4-8(10(9)13)11(16)17-3/h4-6H,1-3H3

InChI Key

HYZFQWSMJIFMQX-UHFFFAOYSA-N

Formula

C11H12Cl2N2O2

SMILES

COC(=O)c1cc(Cl)cc(N=CN(C)C)c1Cl

Molecular Weight¹

275.13

• Δ_fH°_gas : Enthalpy of formation 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-194.78	kJ/mol	Joback Calculated Property
ΔvapH°	67.62	kJ/mol	Joback Calculated Property
log10WS	-3.14		Crippen Calculated Property
logPoct/wat	3.001		Crippen Calculated Property
McVol	189.670	ml/mol	McGowan Calculated Property
Pc	2218.71	kPa	Joback Calculated Property
Inp	[2187.00; 2187.00]
Inp	2187.00		NIST
Inp	2187.00		NIST
Tboil	732.97	K	Joback Calculated Property
Tc	962.73	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Amino-2,5-dichlorobenzoic acid, N-dimethylaminomethylene-, methyl ester.

Sources

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

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