Chemical Properties of 1-Chloro-3-methoxypropan-2-yl acetate

InChI

InChI=1S/C6H11ClO3/c1-5(8)10-6(3-7)4-9-2/h6H,3-4H2,1-2H3

InChI Key

KYQXJEOUFXTRCZ-UHFFFAOYSA-N

Formula

C6H11ClO3

SMILES

COCC(CCl)OC(C)=O

Molecular Weight¹

166.60

Other Names

• 2-Propanol, 1-chloro-3-methoxy-, acetate

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.4735		Relay (... Calculated Property
ΔfG°	-353.65	kJ/mol	Joback Calculated Property
ΔfH°gas	-654.76	kJ/mol	Relay (... Calculated Property
ΔfusH°	15.94	kJ/mol	Joback Calculated Property
ΔvapH°	59.96	kJ/mol	Relay (... Calculated Property
IE	9.97	eV	Relay (... Calculated Property
log10WS	-0.68		Relay (... Calculated Property
logPoct/wat	0.803		Crippen Calculated Property
McVol	120.950	ml/mol	McGowan Calculated Property
Pc	3107.10	kPa	Joback Calculated Property
Inp	[1075.00; 1075.00]
Inp	1075.00		NIST
Inp	1075.00		NIST
Tboil	462.82	K	Relay (... Calculated Property
Tc	638.13	K	Relay (... Calculated Property
Tfus	242.16	K	Relay (... Calculated Property
Vc	0.430	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[246.79; 300.62]	J/mol×K	[472.38; 660.04]
Cp,gas	246.79	J/mol×K	472.38	Joback Calculated Property
Cp,gas	256.58	J/mol×K	503.66	Joback Calculated Property
Cp,gas	266.06	J/mol×K	534.93	Joback Calculated Property
Cp,gas	275.21	J/mol×K	566.21	Joback Calculated Property
Cp,gas	284.03	J/mol×K	597.49	Joback Calculated Property
Cp,gas	292.50	J/mol×K	628.76	Joback Calculated Property
Cp,gas	300.62	J/mol×K	660.04	Joback Calculated Property
η	[0.0002394; 0.0031323]	Pa×s	[266.69; 472.38]
η	0.0031323	Pa×s	266.69	Joback Calculated Property
η	0.0015986	Pa×s	300.97	Joback Calculated Property
η	0.0009362	Pa×s	335.25	Joback Calculated Property
η	0.0006055	Pa×s	369.53	Joback Calculated Property
η	0.0004217	Pa×s	403.82	Joback Calculated Property
η	0.0003108	Pa×s	438.10	Joback Calculated Property
η	0.0002394	Pa×s	472.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Chloro-3-methoxypropan-2-yl acetate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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