Chemical Properties of 1-Hydroxychlordene (CAS 2597-11-7)

InChI

InChI=1S/C10H6Cl6O/c11-6-7(12)9(14)5-3(1-2-4(5)17)8(6,13)10(9,15)16/h1-5,17H

InChI Key

YQWCIPIEEBVRNY-UHFFFAOYSA-N

Formula

C10H6Cl6O

SMILES

OC1C=CC2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl

Molecular Weight¹

354.87

CAS

2597-11-7

Other Names

• 1,7,8,9,10,10-Hexachlorotricyclo[5.2.1.02,6]deca-4,8-dien-3-ol
• 3-Hydroxychlordene
• 4,7-Methano-1H-inden-1-ol, 4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-
• 4,7-Methanoinden-1-ol, 4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-
• Chlordene hydroxide
• hydroxychlordene

• 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°	-3.87	kJ/mol	Joback Calculated Property
ΔfH°gas	-206.84	kJ/mol	Joback Calculated Property
ΔfusH°	29.22	kJ/mol	Joback Calculated Property
ΔvapH°	78.28	kJ/mol	Joback Calculated Property
log10WS	[-5.46; -5.46]
log10WS	-5.46		Aq. Sol...
log10WS	-5.46		Estimat...
logPoct/wat	3.995		Crippen Calculated Property
McVol	189.890	ml/mol	McGowan Calculated Property
Pc	3035.62	kPa	Joback Calculated Property
Inp	[1955.00; 1955.00]
Inp	1955.00		NIST
Inp	1955.00		NIST
Inp	1955.00		NIST
Tboil	764.44	K	Joback Calculated Property
Tc	1014.24	K	Joback Calculated Property
Tfus	578.64	K	Joback Calculated Property
Vc	0.735	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[433.57; 525.74]	J/mol×K	[764.44; 1014.24]
Cp,gas	433.57	J/mol×K	764.44	Joback Calculated Property
Cp,gas	444.06	J/mol×K	806.07	Joback Calculated Property
Cp,gas	455.80	J/mol×K	847.71	Joback Calculated Property
Cp,gas	469.32	J/mol×K	889.34	Joback Calculated Property
Cp,gas	485.13	J/mol×K	930.98	Joback Calculated Property
Cp,gas	503.76	J/mol×K	972.61	Joback Calculated Property
Cp,gas	525.74	J/mol×K	1014.24	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Hydroxychlordene.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook

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