Chemical Properties of Ethane, 1,1-dichloro- (CAS 75-34-3)

InChI

InChI=1S/C2H4Cl2/c1-2(3)4/h2H,1H3

InChI Key

SCYULBFZEHDVBN-UHFFFAOYSA-N

Formula

C2H4Cl2

SMILES

CC(Cl)Cl

Molecular Weight¹

98.96

CAS

75-34-3

Other Names

• 1,1-Dichloorethaan
• 1,1-Dichloraethan
• 1,1-Dichlorethane
• 1,1-Dicloroetano
• 1,1-dichloroethane
• Aethylidenchlorid
• Assymmetrical Dichloroethane
• CH3CHCl2
• Chlorure d'ethylidene
• Cloruro di etilidene
• Dichloromethylmethane
• Ethylidene dichloride
• NCI-C04535
• R-150a
• REFRIGERANT-150A
• Rcra waste number U076
• UN 2362
• ethylidene chloride
• freon 150a

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• μ : Dipole Moment (debye).
• 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_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• NFPA Fire : NFPA Fire Rating.
• NFPA Health : NFPA Health Rating.
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• γ : Surface Tension (N/m).
• Δ_vapS : Entropy of vaporization at a given temperature (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.2400		KDB
ΔcH°liquid	-1246.80 ± 8.40	kJ/mol	NIST
μ	2.00	debye	KDB
ΔfG°	-73.14	kJ/mol	KDB
ΔfH°gas	[-132.50; -127.60]	kJ/mol
ΔfH°gas	-130.00	kJ/mol	KDB
ΔfH°gas	-132.50 ± 3.50	kJ/mol	NIST
ΔfH°gas	-127.60 ± 1.10	kJ/mol	NIST
ΔfH°liquid	-163.30 ± 3.50	kJ/mol	NIST
ΔfusH°	5.81	kJ/mol	Joback Calculated Property
ΔvapH°	[30.60; 30.83]	kJ/mol
ΔvapH°	30.77	kJ/mol	NIST
ΔvapH°	30.83 ± 0.08	kJ/mol	NIST
ΔvapH°	30.62 ± 0.14	kJ/mol	NIST
ΔvapH°	30.60 ± 0.10	kJ/mol	NIST
IE	[11.02; 11.23]	eV
IE	11.04 ± 0.02	eV	NIST
IE	11.02	eV	NIST
IE	11.06	eV	NIST
IE	11.23 ± 0.02	eV	NIST
log10WS	[-1.29; -1.29]
log10WS	-1.29		Aq. Solubility Prediction
log10WS	-1.29		Estimated Solubility
logPoct/wat	1.810		Crippen Calculated Property
McVol	63.520	ml/mol	McGowan Calculated Property
NFPA Fire	3		KDB
NFPA Health	2		KDB
Pc	[5061.00; 5070.00]	kPa
Pc	5070.00	kPa	KDB
Pc	5061.00 ± 10.00	kPa	NIST
Inp	[541.00; 601.60]
Inp	592.20		NIST
Inp	593.30		NIST
Inp	601.60		NIST
Inp	598.90		NIST
Inp	594.20		NIST
Inp	590.60		NIST
Inp	585.90		NIST
Inp	560.00		NIST
Inp	564.00		NIST
Inp	568.00		NIST
Inp	570.00		NIST
Inp	566.00		NIST
Inp	553.00		NIST
Inp	600.00		NIST
Inp	541.00		NIST
Inp	568.00		NIST
Inp	568.00		NIST
Inp	559.00		NIST
Inp	579.00		NIST
Inp	559.00		NIST
Inp	563.00		NIST
Inp	563.00		NIST
Inp	553.00		NIST
Inp	568.00		NIST
Inp	563.00		NIST
I	[881.00; 901.48]
I	901.00		NIST
I	900.52		NIST
I	901.48		NIST
I	886.92		NIST
I	881.00		NIST
I	901.00		NIST
S°liquid	211.75	J/mol×K	NIST
Tboil	[273.15; 331.15]	K
Tboil	330.50	K	KDB
Tboil	330.50	K	NIST
Tboil	330.44 ± 0.20	K	NIST
Tboil	330.44 ± 0.20	K	NIST
Tboil	330.44 ± 0.20	K	NIST
Tboil	330.25 ± 0.20	K	NIST
Tboil	330.40	K	NIST
Tboil	330.50 ± 0.50	K	NIST
Tboil	330.45 ± 0.30	K	NIST
Tboil	330.55 ± 0.20	K	NIST
Tboil	330.60 ± 0.50	K	NIST
Tboil	330.40 ± 0.50	K	NIST
Tboil	331.00 ± 7.00	K	NIST
Tboil	330.46 ± 0.20	K	NIST
Tboil	330.20 ± 0.20	K	NIST
Tboil	330.40 ± 0.50	K	NIST
Tboil	Outlier 273.15 ± 0.50	K	NIST
Tboil	330.50 ± 0.30	K	NIST
Tboil	331.15 ± 2.00	K	NIST
Tboil	330.00 ± 2.00	K	NIST
Tc	[523.00; 523.40]	K
Tc	523.00	K	KDB
Tc	523.40 ± 0.20	K	NIST
Tfus	[174.00; 176.70]	K
Tfus	176.19	K	KDB
Tfus	176.20	K	Aq. Solubility Prediction
Tfus	174.00 ± 1.50	K	NIST
Tfus	176.70 ± 1.00	K	NIST
Tfus	176.50 ± 0.30	K	NIST
Ttriple	176.18 ± 0.02	K	NIST
Vc	0.236	m3/kmol	KDB
Zc	0.2751580		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,liquid	[119.60; 127.20]	J/mol×K	[180.00; 300.00]
Cp,liquid	119.60	J/mol×K	180.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	119.90	J/mol×K	190.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	120.20	J/mol×K	200.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	120.60	J/mol×K	210.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	121.10	J/mol×K	220.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	121.60	J/mol×K	230.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	122.10	J/mol×K	240.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	122.70	J/mol×K	250.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	123.40	J/mol×K	260.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	124.10	J/mol×K	270.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	124.30	J/mol×K	273.15	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	124.80	J/mol×K	280.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	125.60	J/mol×K	290.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	127.20	J/mol×K	298.00	NIST
Cp,liquid	120.90	J/mol×K	298.00	NIST
Cp,liquid	126.40	J/mol×K	298.15	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	126.27	J/mol×K	298.15	NIST
Cp,liquid	126.50	J/mol×K	300.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
ΔfusH	[7.87; 7.87]	kJ/mol	[176.18; 176.20]
ΔfusH	7.87	kJ/mol	176.18	NIST
ΔfusH	7.87	kJ/mol	176.20	NIST
ΔfusH	7.87	kJ/mol	176.20	NIST
ΔvapH	[28.20; 34.40]	kJ/mol	[262.00; 449.00]
ΔvapH	31.90	kJ/mol	262.00	NIST
ΔvapH	34.40	kJ/mol	271.50	NIST
ΔvapH	31.00	kJ/mol	293.00	NIST
ΔvapH	31.00 ± 29.00	kJ/mol	293.00	NIST
ΔvapH	28.85	kJ/mol	330.40	NIST
ΔvapH	28.70	kJ/mol	330.70	KDB
ΔvapH	33.50	kJ/mol	335.50	NIST
ΔvapH	29.20	kJ/mol	429.00	NIST
ΔvapH	28.20	kJ/mol	449.00	NIST
ρl	1168.00	kg/m3	298.00	KDB
ΔfusS	44.67	J/mol×K	176.18	NIST
γ	0.02	N/m	293.20	KDB
ΔvapS	105.81	J/mol×K	293.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[74.40; 139.59]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			2.51700e+01
Coefficient B			2.13320e-01
Coefficient C			-1.29000e-04
Coefficient D			3.01000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	74.40	J/mol×K	273.00	Calculated Property
Cp,gas	85.83	J/mol×K	353.78	Calculated Property
Cp,gas	95.98	J/mol×K	434.56	Calculated Property
Cp,gas	104.96	J/mol×K	515.33	Calculated Property
Cp,gas	112.87	J/mol×K	596.11	Calculated Property
Cp,gas	119.79	J/mol×K	676.89	Calculated Property
Cp,gas	125.83	J/mol×K	757.67	Calculated Property
Cp,gas	131.08	J/mol×K	838.44	Calculated Property
Cp,gas	135.64	J/mol×K	919.22	Calculated Property
Cp,gas	139.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0031217; 0.0002325]	Pa×s	[175.92; 366.24]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.07673e+01
Coefficient B			8.79220e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			175.92
Temperature range, max.			366.24
η	0.0031217	Pa×s	175.92	Calculated Property
η	0.0018259	Pa×s	197.06	Calculated Property
η	0.0011849	Pa×s	218.21	Calculated Property
η	0.0008300	Pa×s	239.36	Calculated Property
η	0.0006160	Pa×s	260.51	Calculated Property
η	0.0004781	Pa×s	281.65	Calculated Property
η	0.0003845	Pa×s	302.80	Calculated Property
η	0.0003181	Pa×s	323.95	Calculated Property
η	0.0002693	Pa×s	345.09	Calculated Property
η	0.0002325	Pa×s	366.24	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 5049.80]	kPa	[240.70; 523.00]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.45193e+01
Coefficient B			-2.92184e+03
Coefficient C			-3.53950e+01
Temperature range, min.			240.70
Temperature range, max.			523.00
Pvap	1.33	kPa	240.70	Calculated Property
Pvap	8.79	kPa	272.07	Calculated Property
Pvap	37.28	kPa	303.43	Calculated Property
Pvap	116.81	kPa	334.80	Calculated Property
Pvap	294.69	kPa	366.17	Calculated Property
Pvap	633.36	kPa	397.53	Calculated Property
Pvap	1204.92	kPa	428.90	Calculated Property
Pvap	2084.61	kPa	460.27	Calculated Property
Pvap	3344.71	kPa	491.63	Calculated Property
Pvap	5049.80	kPa	523.00	Calculated Property
Pvap	[1.98e-03; 5117.20]	kPa	[176.19; 523.00]	KDB Vapor Pressure Data
Equation			ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K
Coefficient A			7.31701e+01
Coefficient B			-5.95760e+03
Coefficient C			-8.86262e+00
Coefficient D			8.18126e-06
Coefficient E			0.00000e+00
Temperature range, min.			176.19
Temperature range, max.			523.00
Pvap	1.98e-03	kPa	176.19	Calculated Property
Pvap	0.17	kPa	214.72	Calculated Property
Pvap	3.07	kPa	253.26	Calculated Property
Pvap	23.22	kPa	291.79	Calculated Property
Pvap	101.84	kPa	330.33	Calculated Property
Pvap	314.21	kPa	368.86	Calculated Property
Pvap	766.52	kPa	407.40	Calculated Property
Pvap	1593.33	kPa	445.93	Calculated Property
Pvap	2966.07	kPa	484.47	Calculated Property
Pvap	5117.20	kPa	523.00	Calculated Property
Pvap	[0.86; 22.01]	kPa	[234.38; 290.76]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.42629e+01
Coefficient B			-2.79843e+03
Coefficient C			-4.02600e+01
Reference			Li and Pitzer, 1956
Temperature range, min.			234.38
Temperature range, max.			290.76
Pvap	0.86	kPa	234.38	Calculated Property
Pvap	1.35	kPa	240.64	Calculated Property
Pvap	2.06	kPa	246.91	Calculated Property
Pvap	3.06	kPa	253.17	Calculated Property
Pvap	4.46	kPa	259.44	Calculated Property
Pvap	6.36	kPa	265.70	Calculated Property
Pvap	8.89	kPa	271.97	Calculated Property
Pvap	12.22	kPa	278.23	Calculated Property
Pvap	16.53	kPa	284.50	Calculated Property
Pvap	22.01	kPa	290.76	Calculated Property
Pvap	[0.13; 100.78]	kPa	[212.50; 330.60]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.43256e+01
Coefficient B			-2.83024e+03
Coefficient C			-3.92040e+01
Reference			Stull, 1947
Temperature range, min.			212.50
Temperature range, max.			330.60
Pvap	0.13	kPa	212.50	Calculated Property
Pvap	0.42	kPa	225.62	Calculated Property
Pvap	1.15	kPa	238.74	Calculated Property
Pvap	2.76	kPa	251.87	Calculated Property
Pvap	5.99	kPa	264.99	Calculated Property
Pvap	11.93	kPa	278.11	Calculated Property
Pvap	22.10	kPa	291.23	Calculated Property
Pvap	38.53	kPa	304.36	Calculated Property
Pvap	63.75	kPa	317.48	Calculated Property
Pvap	100.78	kPa	330.60	Calculated Property

Similar Compounds

Find more compounds similar to Ethane, 1,1-dichloro-.

Mixtures

• Ethane, 1,1-dichloro- + Water
• Ethane, 1,1-dichloro- + 1,3,5,7-Tetraazabicyclo[3.3.1]nonane, 3,7-dinitroso-

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Solubility of 3,7-Dinitro-1,3,5,7-tetraazabicyclo [3.3.1] Nonane in Ethanenitrile, Methanol, 1,1-Dichloroethane, Dimethyl Sulfoxide, Acetone, and Mixed Solvents
• Determination of Henry's Law Constants Using Internal Standards with Benchmark Values
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure
• Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD

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