Chemical Properties of cis-Chlordane (CAS 5103-71-9)

InChI

InChI=1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2/t2-,3-,4-,5-,8?,9?/m0/s1

InChI Key

BIWJNBZANLAXMG-FZOZSSNHSA-N

Formula

C10H6Cl8

SMILES

ClC1=C(Cl)C2(Cl)C3C(Cl)C(Cl)CC3C1(Cl)C2(Cl)Cl

Molecular Weight¹

409.78

CAS

5103-71-9

Other Names

• 4,7-Methano-1H-indene, 1,2,4,5,6,7,8,8-octachloro-2,3,3a,4,7,7a-hexahydro-, (1«alpha»,2«alpha»,3a«alpha»,4«beta»,7«beta»,7a«alpha»)-
• 4,7-Methanoindan, 1«alpha»,2«alpha»,4«beta»,5,6,7«beta»,8,8-octachloro-3a«alpha»,4,7,7a«alpha»-tetrahydro-
• «alpha»-Chlordan
• «alpha»-Chlordane
• cis-Chlordan
• Chlordan, cis-
• 4,7-Methano-1H-indene, 1,2,4,5,6,7,8,8-octachloro-2,3,3a,4,7,7a-hexahydro-, (1R,2S,3aS,4S,7R,7aS)-rel-
• (1«alpha»,2«alpha»,3a«alpha»,4«beta»,7«beta»,7a«alpha»)-1,2,4,5,6,7,8,8-octachloro-2,3,3a,4,7,7a-hexahydro-4,7-methano-1H-indene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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.
• I : Polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	33.37	kJ/mol	Joback Calculated Property
log10WS	-6.73		Relay (1.0) Calculated Property
logPoct/wat	5.683		Crippen Calculated Property
McVol	212.800	ml/mol	McGowan Calculated Property
Inp	[2050.00; 2118.10]
Inp	2056.00		NIST
Inp	2050.00		NIST
Inp	2081.80		NIST
Inp	Outlier 2118.10		NIST
Inp	2056.00		NIST
Inp	2050.00		NIST
Inp	2081.80		NIST
I	[2842.00; 2842.00]
I	2842.00		NIST
I	2842.00		NIST
Tfus	[377.30; 381.19]	K
Tfus	381.19 ± 0.20	K	NIST
Tfus	377.30 ± 0.20	K	NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[461.86; 565.73]	J/mol×K	[743.29; 1021.42]
Cp,gas	461.86	J/mol×K	743.29	Joback Calculated Property
Cp,gas	473.85	J/mol×K	789.64	Joback Calculated Property
Cp,gas	487.02	J/mol×K	836.00	Joback Calculated Property
Cp,gas	502.09	J/mol×K	882.35	Joback Calculated Property
Cp,gas	519.76	J/mol×K	928.71	Joback Calculated Property
Cp,gas	540.74	J/mol×K	975.06	Joback Calculated Property
Cp,gas	565.73	J/mol×K	1021.42	Joback Calculated Property
ΔfusH	23.15	kJ/mol	379.90	NIST
ΔvapH	[82.00; 83.00]	kJ/mol	[366.00; 398.00]
ΔvapH	83.00	kJ/mol	366.00	NIST
ΔvapH	82.00	kJ/mol	398.00	NIST

Similar Compounds

Find more compounds similar to cis-Chlordane.

Sources

• 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

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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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