Chemical Properties of Cyclohexanecarbonyl chloride (CAS 2719-27-9)

InChI

InChI=1S/C7H11ClO/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2

InChI Key

RVOJTCZRIKWHDX-UHFFFAOYSA-N

Formula

C7H11ClO

SMILES

O=C(Cl)C1CCCCC1

Molecular Weight¹

146.62

CAS

2719-27-9

Other Names

• Chlorocarbonylcyclohexane
• Cyclohexanoyl chloride
• Cyclohexylcarbonyl chloride
• Hexahydrobenzoyl chloride
• Cyclohexanecarboxylic acid chloride

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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°	-108.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-261.81	kJ/mol	Joback Calculated Property
ΔfusH°	11.52	kJ/mol	Joback Calculated Property
ΔvapH°	42.74	kJ/mol	Joback Calculated Property
log10WS	-2.33		Crippen Calculated Property
logPoct/wat	2.332		Crippen Calculated Property
McVol	112.440	ml/mol	McGowan Calculated Property
Pc	3633.35	kPa	Joback Calculated Property
Tboil	[454.00; 457.20]	K
Tboil	457.20	K	NIST
Tboil	454.00 ± 4.00	K	NIST
Tboil	457.00 ± 3.00	K	NIST
Tc	693.24	K	Joback Calculated Property
Tfus	255.88	K	Joback Calculated Property
Vc	0.415	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[224.45; 300.65]	J/mol×K	[470.41; 693.24]
Cp,gas	224.45	J/mol×K	470.41	Joback Calculated Property
Cp,gas	239.24	J/mol×K	507.55	Joback Calculated Property
Cp,gas	253.16	J/mol×K	544.69	Joback Calculated Property
Cp,gas	266.24	J/mol×K	581.82	Joback Calculated Property
Cp,gas	278.49	J/mol×K	618.96	Joback Calculated Property
Cp,gas	289.96	J/mol×K	656.10	Joback Calculated Property
Cp,gas	300.65	J/mol×K	693.24	Joback Calculated Property
η	[0.0003691; 0.0054577]	Pa×s	[255.88; 470.41]
η	0.0054577	Pa×s	255.88	Joback Calculated Property
η	0.0026455	Pa×s	291.63	Joback Calculated Property
η	0.0015022	Pa×s	327.39	Joback Calculated Property
η	0.0009535	Pa×s	363.14	Joback Calculated Property
η	0.0006566	Pa×s	398.90	Joback Calculated Property
η	0.0004808	Pa×s	434.65	Joback Calculated Property
η	0.0003691	Pa×s	470.41	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Cyclohexanecarbonyl chloride.

Sources

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

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