2-Propanol, 1-(dimethylamino)- (CAS 108-16-7)

InChI

InChI=1S/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3

InChI Key

NCXUNZWLEYGQAH-UHFFFAOYSA-N

Formula

C5H13NO

SMILES

CC(O)CN(C)C

Molecular Weight¹

103.16

CAS

108-16-7

Other Names

(+-)-1-(dimethylamino)-2-propanol
1,1-(Dimethylamino)propanol-2
1,1-Dimethylaminopropan-2-ol
1-(Dimethylamino)propan-2-ol
1-(dimethylamino)-2-propanol
2-(Dimethylamino)-1-methylethanol
2-Propanol, 1,1-(dimethylamino)-
3-Dimethylamino-2-propanol
DL-1-(dimethylamino)-2-propanol
Dimepranol
Dimethyl(2-hydroxypropyl)amine
Dimethylisopropanolamine
INN
N,N-(Dimethylamino)-2-propanol
N,N-Dimethyl-2-hydroxypropylamine
N,N-Dimethylisopropanolamine
NSC 3163

ω : Acentric Factor.
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).
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).
P_vap : Vapor pressure (kPa).
ρ_l : Liquid Density (kg/m³).
γ : Surface Tension (N/m).
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
ω	0.5415		Relay (1.0) Calculated Property
Δ_fG°	-37.26	kJ/mol	Joback Calculated Property
Δ_fH°_gas	-247.84	kJ/mol	Relay (1.0) Calculated Property
Δ_fusH°	12.29	kJ/mol	Joback Calculated Property
Δ_vapH°	52.33	kJ/mol	Relay (1.0) Calculated Property
IE	8.40	eV	Relay (1.0) Calculated Property
log₁₀WS	1.31		Relay (1.0) Calculated Property
logP_oct/wat	-0.071		Crippen Calculated Property
McVol	97.160	ml/mol	McGowan Calculated Property
P_c	3906.25	kPa	Joback Calculated Property
T_boil	397.20	K	NIST
T_c	558.78	K	Relay (1.0) Calculated Property
T_fus	214.79	K	Relay (1.0) Calculated Property
V_c	0.375	m³/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
C_p,gas	[197.91; 250.40]	J/mol×K	[417.98; 581.92]

C_p,gas	197.91	J/mol×K	417.98	Joback Calculated Property
C_p,gas	207.62	J/mol×K	445.30	Joback Calculated Property
C_p,gas	216.93	J/mol×K	472.63	Joback Calculated Property
C_p,gas	225.85	J/mol×K	499.95	Joback Calculated Property
C_p,gas	234.40	J/mol×K	527.28	Joback Calculated Property
C_p,gas	242.58	J/mol×K	554.60	Joback Calculated Property
C_p,gas	250.40	J/mol×K	581.92	Joback Calculated Property
P_vap	[4.13; 23.06]	kPa	[298.49; 333.04]

P_vap	4.13	kPa	298.49	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	6.59	kPa	303.88	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	8.03	kPa	308.43	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	10.34	kPa	313.34	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	12.51	kPa	318.26	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	15.84	kPa	323.60	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	18.73	kPa	328.26	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
P_vap	23.06	kPa	333.04	Experimental measurement and modeling study on CO2 equilibrium solubility, density and viscosity for 1-dimethylamino-2-propanol (1DMA2P) solution
ρ_l	[820.90; 845.20]	kg/m³	[298.15; 323.15]

ρ_l	845.20	kg/m³	298.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
ρ_l	840.40	kg/m³	303.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
ρ_l	835.60	kg/m³	308.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
ρ_l	830.70	kg/m³	313.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
ρ_l	825.90	kg/m³	318.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
ρ_l	820.90	kg/m³	323.15	Density Measurements of Unloaded and CO2-Loaded 1-Dimethylamino-2-propanol at Temperatures (298.15 to 353.15) K
γ	[0.02; 0.02]	N/m	[303.20; 323.20]

γ	0.02	N/m	303.20	Surface thermodynamics of DMA2P, DMA2P-MEA and DMA2P-PZ aqueous solutions
γ	0.02	N/m	303.20	Analysis of Surface Thermodynamics for Amino Acid Ionic Liquid-1-Dimethylamino-2-propanol Aqueous Blends
γ	0.02	N/m	308.20	Analysis of Surface Thermodynamics for Amino Acid Ionic Liquid-1-Dimethylamino-2-propanol Aqueous Blends
γ	0.02	N/m	313.20	Surface thermodynamics of DMA2P, DMA2P-MEA and DMA2P-PZ aqueous solutions
γ	0.02	N/m	313.20	Analysis of Surface Thermodynamics for Amino Acid Ionic Liquid-1-Dimethylamino-2-propanol Aqueous Blends
γ	0.02	N/m	318.20	Analysis of Surface Thermodynamics for Amino Acid Ionic Liquid-1-Dimethylamino-2-propanol Aqueous Blends
γ	0.02	N/m	323.20	Surface thermodynamics of DMA2P, DMA2P-MEA and DMA2P-PZ aqueous solutions
γ	0.02	N/m	323.20	Analysis of Surface Thermodynamics for Amino Acid Ionic Liquid-1-Dimethylamino-2-propanol Aqueous Blends

Correlations

Property	Value	Unit	Temperature (K)	Source
P_vap	[1.32; 202.65]	kPa	[302.99; 419.21]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.61920e+01
Coefficient B			-3.99873e+03
Coefficient C			-5.16970e+01
Temperature range, min.			302.99
Temperature range, max.			419.21

P_vap	1.32	kPa	302.99	Calculated Property
P_vap	2.88	kPa	315.90	Calculated Property
P_vap	5.83	kPa	328.82	Calculated Property
P_vap	11.08	kPa	341.73	Calculated Property
P_vap	19.94	kPa	354.64	Calculated Property
P_vap	34.20	kPa	367.56	Calculated Property
P_vap	56.23	kPa	380.47	Calculated Property
P_vap	89.04	kPa	393.38	Calculated Property
P_vap	136.35	kPa	406.30	Calculated Property
P_vap	202.65	kPa	419.21	Calculated Property

Similar Compounds

2-Propanol, 1-[bis(2-hydroxyethyl)amino]-.

1,1'-[(2-hydroxyethyl)imino]dipropan-2-ol.

1,4-Piperazinediethanol, «alpha»,«alpha»'-dimethyl-.

1,4-Bis-(2-hydroxypropyl)-2-methylpiperazine.

Find more compounds similar to 2-Propanol, 1-(dimethylamino)-.

Mixtures

Sources

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