Chemical Properties of Mirex (CAS 2385-85-5)

InChI

InChI=1S/C10Cl12/c11-1-2(12)7(17)4(14)3(13,5(1,15)9(7,19)20)6(1,16)10(21,22)8(2,4)18

InChI Key

GVYLCNUFSHDAAW-UHFFFAOYSA-N

Formula

SMILES

ClC1(Cl)C2(Cl)C3(Cl)C4(Cl)C(Cl)(Cl)C5(Cl)C3(Cl)C1(Cl)C5(Cl)C24Cl

Molecular Weight¹

545.54

CAS

2385-85-5

Other Names

1,1a,2,2,3,3a,4,5,5,5a,5b,6-Dodecachlorooctahydro-1,3,4-metheno-1H-cyclobuta(cd)pentalene
1,2,3,4,5,5-Hexachloro-1,3-cyclopentadiene dimer
1,3,4-Metheno-1H-cyclobuta(cd)pentalene, dodecachlorooctahydro-
1,3,4-Metheno-1H-cyclobuta[cd]pentalene, 1,1a,2,2,3,3a,4,5,5,5a,5b,6-dodecachlorooctahydro-
1,3,4-Metheno-2H-cyclobuta[cd]pentalene, dodecachlorooctahydro-
1,3-Cyclopentadiene, 1,2,3,4,5,5-hexachloro-, dimer
2385-85-5
Bichlorendo
CG-1283
Cyclopentadiene, hexachloro-, dimer
Decane,perchloropentacyclo-
Dechlorane
Dechlorane 4070
Dodecachlorooctahydro-1,3,4-metheno-1H-cyclobuta(cd)pentalene
Dodecachlorooctahydro-1,3,4-metheno-2H-cyclobuta[cd]pentalene
Dodecachloropentacyclo(3,3,2,0(2,6),0(3,9),0(7,10))decane
Dodecachloropentacyclodecane
ENT 25,719
Ferriamicide
GC 1283
HRS l276
Hexachlorocyclopentadiene Dimer
NCI-C06428
NSC 26107
NSC 37656
Paramex
Pentacyclodecane, dodecachloro-
Perchlorodihomocubane
Perchloropentacyclo(5.2.1.0(2,6),0(3,9),0(5,8)decane
Perchloropentacyclo[5.2.1.0(2,6).0(3,9).0(5,8)]decane
Perchloropentacyclodecane
dodecachloropentacyclo[5.2.1.02,6.03,9.05,8]decane

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).
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.

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Physical Properties

Property	Value	Unit	Source
Δ_fG°	160.96	kJ/mol	Joback Calculated Property
Δ_fH°_gas	6.89	kJ/mol	Joback Calculated Property
Δ_fusH°	15.57	kJ/mol	Joback Calculated Property
Δ_vapH°	76.12	kJ/mol	Joback Calculated Property
log₁₀WS	[-6.80; -6.80]
log₁₀WS	-6.80		Aq. Sol...
log₁₀WS	-6.80		Estimat...
logP_oct/wat	6.223		Crippen Calculated Property
McVol	244.340	ml/mol	McGowan Calculated Property
P_c	3045.68	kPa	Joback Calculated Property
I_np	[2470.00; 2494.00]
I_np	2494.00		NIST
I_np	2470.00		NIST
I_np	2472.00		NIST
I_np	2470.00		NIST
I_np	2470.00		NIST
I	[3348.00; 3348.00]
I	3348.00		NIST
I	3348.00		NIST
T_boil	868.76	K	Joback Calculated Property
T_c	1210.15	K	Joback Calculated Property
T_fus	886.60	K	Joback Calculated Property
V_c	0.984	m³/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
C_p,gas	[502.59; 1140.99]	J/mol×K	[868.76; 1210.15]

C_p,gas	502.59	J/mol×K	868.76	Joback Calculated Property
C_p,gas	544.69	J/mol×K	925.66	Joback Calculated Property
C_p,gas	607.06	J/mol×K	982.56	Joback Calculated Property
C_p,gas	693.78	J/mol×K	1039.45	Joback Calculated Property
C_p,gas	808.95	J/mol×K	1096.35	Joback Calculated Property
C_p,gas	956.66	J/mol×K	1153.25	Joback Calculated Property
C_p,gas	1140.99	J/mol×K	1210.15	Joback Calculated Property
Δ_vapH	90.30	kJ/mol	398.00	NIST

Similar Compounds

Find more compounds similar to Mirex.

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