Chemical Properties of Chlorbicyclen (CAS 2550-75-6)

InChI

InChI=1S/C9H6Cl8/c10-1-3-4(2-11)8(15)6(13)5(12)7(3,14)9(8,16)17/h3-4H,1-2H2

InChI Key

FUZORIOHZSVKAW-UHFFFAOYSA-N

Formula

C9H6Cl8

SMILES

ClCC1C(CCl)C2(Cl)C(Cl)=C(Cl)C1(Cl)C2(Cl)Cl

Molecular Weight¹

397.77

CAS

2550-75-6

Other Names

• Bicyclo[2.2.1]hept-2-ene, 1,2,3,4,7,7-hexachloro-5,6-bis(chloromethyl)-
• AC 12402
• Alodan
• Cyclodan
• Hercules 426
• Hercules 12402
• 2-Norbornene, 1,2,3,4,7,7-Hexachloro-5,6-bis(chloromethyl)-
• 5,6-Bis-(chloromethyl)-1,2,3,4,7,7-hexachlorobicyclo-(2,2,1)-2-heptene
• Nodon
• Allodan
• 2,3-Bis(chloromethyl)-1,4,5,6,7,7-hexachlorobicyclo(2.2.1)hept-4-ene
• 1,2,3,4,7,7-Hexachloro-5,6-bis(chloromethyl)-2-norbornene
• Alodan (pesticide)
• NSC 41891

• 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).
• 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°	9.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-196.03	kJ/mol	Joback Calculated Property
ΔfusH°	31.57	kJ/mol	Joback Calculated Property
ΔvapH°	67.94	kJ/mol	Joback Calculated Property
log10WS	-5.80		Crippen Calculated Property
logPoct/wat	5.542		Crippen Calculated Property
McVol	209.570	ml/mol	McGowan Calculated Property
Pc	2377.22	kPa	Joback Calculated Property
Inp	[1979.90; 2013.70]
Inp	1979.90		NIST
Inp	2013.70		NIST
Tboil	718.34	K	Joback Calculated Property
Tc	984.40	K	Joback Calculated Property
Tfus	547.69	K	Joback Calculated Property
Vc	0.815	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[425.61; 507.90]	J/mol×K	[718.34; 984.40]
Cp,gas	425.61	J/mol×K	718.34	Joback Calculated Property
Cp,gas	435.34	J/mol×K	762.68	Joback Calculated Property
Cp,gas	445.90	J/mol×K	807.03	Joback Calculated Property
Cp,gas	457.86	J/mol×K	851.37	Joback Calculated Property
Cp,gas	471.79	J/mol×K	895.71	Joback Calculated Property
Cp,gas	488.28	J/mol×K	940.06	Joback Calculated Property
Cp,gas	507.90	J/mol×K	984.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Chlorbicyclen.

Sources

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

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