Chemical Properties of Dibenzo[b,e][1,4]dioxin, 1,6-dichloro- (CAS 38178-38-0)

InChI

InChI=1S/C12H6Cl2O2/c13-7-3-1-5-9-11(7)16-10-6-2-4-8(14)12(10)15-9/h1-6H

InChI Key

MAWMBEVNJGEDAD-UHFFFAOYSA-N

Formula

C12H6Cl2O2

SMILES

Clc1cccc2c1Oc1cccc(Cl)c1O2

Molecular Weight¹

253.08

CAS

38178-38-0

Other Names

• 1,6-Dichlorodibenzo[b,e] [1,4]dioxin

• 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 a given temperature (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).
• 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
ΔfG°	120.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-60.01	kJ/mol	Joback Calculated Property
ΔfusH°	36.88	kJ/mol	Joback Calculated Property
ΔvapH°	67.35	kJ/mol	Joback Calculated Property
log10WS	-4.36		Crippen Calculated Property
logPoct/wat	4.891		Crippen Calculated Property
McVol	157.780	ml/mol	McGowan Calculated Property
Pc	3372.36	kPa	Joback Calculated Property
Inp	[1968.00; 1969.00]
Inp	1968.00		NIST
Inp	1969.00		NIST
Inp	1969.00		NIST
Tboil	683.14	K	Joback Calculated Property
Tc	945.37	K	Joback Calculated Property
Tfus	466.60	K	Joback Calculated Property
Vc	0.598	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[357.63; 407.80]	J/mol×K	[683.14; 945.37]
Cp,gas	357.63	J/mol×K	683.14	Joback Calculated Property
Cp,gas	367.82	J/mol×K	726.84	Joback Calculated Property
Cp,gas	377.11	J/mol×K	770.55	Joback Calculated Property
Cp,gas	385.63	J/mol×K	814.25	Joback Calculated Property
Cp,gas	393.51	J/mol×K	857.96	Joback Calculated Property
Cp,gas	400.86	J/mol×K	901.66	Joback Calculated Property
Cp,gas	407.80	J/mol×K	945.37	Joback Calculated Property
η	[0.0005130; 0.0015388]	Pa×s	[466.60; 683.14]
η	0.0015388	Pa×s	466.60	Joback Calculated Property
η	0.0011999	Pa×s	502.69	Joback Calculated Property
η	0.0009673	Pa×s	538.78	Joback Calculated Property
η	0.0008012	Pa×s	574.87	Joback Calculated Property
η	0.0006785	Pa×s	610.96	Joback Calculated Property
η	0.0005854	Pa×s	647.05	Joback Calculated Property
η	0.0005130	Pa×s	683.14	Joback Calculated Property
ΔsubH	113.60 ± 2.30	kJ/mol	365.50	NIST

Similar Compounds

Find more compounds similar to Dibenzo[b,e][1,4]dioxin, 1,6-dichloro-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.