Chemical Properties of trans-Chlordane (CAS 5103-74-2)

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-SVSLFMFOSA-N

Formula

C10H6Cl8

SMILES

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

Molecular Weight¹

409.78

CAS

5103-74-2

Other Names

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

• 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).
• 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).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I : 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°	71.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-164.21	kJ/mol	Joback Calculated Property
ΔfusH°	33.37	kJ/mol	Joback Calculated Property
ΔvapH°	69.77	kJ/mol	Joback Calculated Property
log10WS	-6.33		Crippen Calculated Property
logPoct/wat	5.683		Crippen Calculated Property
McVol	212.800	ml/mol	McGowan Calculated Property
Pc	2379.54	kPa	Joback Calculated Property
Inp	[2021.00; 2089.00]
Inp	2089.00		NIST
Inp	2021.00		NIST
Inp	2021.00		NIST
I	2829.00		NIST
Tboil	743.29	K	Joback Calculated Property
Tc	1021.42	K	Joback Calculated Property
Tfus	572.66	K	Joback Calculated Property
Vc	0.827	m3/kmol	Joback Calculated Property

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
ΔvapH	[80.70; 81.70]	kJ/mol	[391.00; 398.00]
ΔvapH	81.70	kJ/mol	391.00	NIST
ΔvapH	80.70	kJ/mol	398.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[459.62; 855.87]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.12705e+01
Coefficient B			-5.16209e+03
Coefficient C			1.03890e+01
Temperature range, min.			459.62
Temperature range, max.			855.87
Pvap	1.33	kPa	459.62	Calculated Property
Pvap	3.42	kPa	503.65	Calculated Property
Pvap	7.54	kPa	547.68	Calculated Property
Pvap	14.83	kPa	591.70	Calculated Property
Pvap	26.61	kPa	635.73	Calculated Property
Pvap	44.29	kPa	679.76	Calculated Property
Pvap	69.36	kPa	723.79	Calculated Property
Pvap	103.25	kPa	767.81	Calculated Property
Pvap	147.28	kPa	811.84	Calculated Property
Pvap	202.64	kPa	855.87	Calculated Property

Similar Compounds

Find more compounds similar to trans-Chlordane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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