Chemical Properties of 3-Amino-1-propanol, N,O-diacetyl-

InChI

InChI=1S/C7H13NO3/c1-6(9)8-4-3-5-11-7(2)10/h3-5H2,1-2H3,(H,8,9)

InChI Key

DPWZYRHWCCZPDJ-UHFFFAOYSA-N

Formula

C7H13NO3

SMILES

CC(=O)NCCCOC(C)=O

Molecular Weight¹

159.18

• 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°	-265.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-491.72	kJ/mol	Joback Calculated Property
ΔfusH°	23.37	kJ/mol	Joback Calculated Property
ΔvapH°	53.51	kJ/mol	Joback Calculated Property
log10WS	-0.58		Crippen Calculated Property
logPoct/wat	0.076		Crippen Calculated Property
McVol	128.480	ml/mol	McGowan Calculated Property
Pc	3199.16	kPa	Joback Calculated Property
Inp	[1346.60; 1346.60]
Inp	1346.60		NIST
Inp	1346.60		NIST
Tboil	539.89	K	Joback Calculated Property
Tc	728.58	K	Joback Calculated Property
Tfus	343.40	K	Joback Calculated Property
Vc	0.492	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[299.98; 358.74]	J/mol×K	[539.89; 728.58]
Cp,gas	299.98	J/mol×K	539.89	Joback Calculated Property
Cp,gas	310.96	J/mol×K	571.34	Joback Calculated Property
Cp,gas	321.46	J/mol×K	602.79	Joback Calculated Property
Cp,gas	331.48	J/mol×K	634.24	Joback Calculated Property
Cp,gas	341.04	J/mol×K	665.68	Joback Calculated Property
Cp,gas	350.12	J/mol×K	697.13	Joback Calculated Property
Cp,gas	358.74	J/mol×K	728.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Amino-1-propanol, N,O-diacetyl-.

Sources

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

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