Chemical Properties of Dextroamphetamine (CAS 51-64-9)

InChI

InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1

InChI Key

KWTSXDURSIMDCE-QMMMGPOBSA-N

Formula

C9H13N

SMILES

CC(N)Cc1ccccc1

Molecular Weight¹

135.21

CAS

51-64-9

Other Names

• (+)-(S)-Amphetamine
• (+)-Amphetamine
• (+)-«alpha»-Methylphenethylamine
• (+)-«alpha»-Methylphenylethylamine
• (2S)-(+)-Amphetamine
• (S)-(+)-Amphetamine
• (S)-(+)-«beta»-Phenylisopropylamine
• (S)-1-Phenyl-2-aminopropane
• (S)-1-Phenyl-2-propylamine
• (S)-1-phenylpropan-2-amine
• (S)-Amphetamine
• (S)-«alpha»-Phenylethylamine
• Amphetamine, (d)
• Amsustain
• Benzeneethanamine, «alpha»-methyl-, (S)-
• D-(S)-amphetamine
• D-1-Phenyl-2-aminopropan
• D-1-Phenyl-2-aminopropane
• D-2-Amino-1-phenylpropane
• D-AM
• D-amphetamine
• D-«alpha»-methylphenethylamine
• Dephadren
• Dexacaps
• Dexadrine
• Dexamfetamine
• Dexamphetamine
• Dexidrine
• NSC-73713
• Phenethylamine, D-«alpha»-methyl-
• Phenethylamine, «alpha»-methyl-, (+)-
• Phenethylamine, «alpha»-methyl-, d-
• «alpha»-Methylphenethylamine, d-form

• 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).
• 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).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I : 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	0.4356		Relay (1.0) Calculated Property
ΔfG°	201.32	kJ/mol	Joback Calculated Property
ΔfH°gas	27.43	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.78	kJ/mol	Joback Calculated Property
ΔvapH°	57.04	kJ/mol	Relay (1.0) Calculated Property
IE	8.57	eV	Relay (1.0) Calculated Property
log10WS	-1.17		Relay (1.0) Calculated Property
logPoct/wat	1.576		Crippen Calculated Property
McVol	123.890	ml/mol	McGowan Calculated Property
Pc	3517.91	kPa	Joback Calculated Property
Inp	[1110.00; 1155.00]
Inp	1116.00		NIST
Inp	1135.00		NIST
Inp	1138.00		NIST
Inp	1141.00		NIST
Inp	1144.00		NIST
Inp	1148.00		NIST
Inp	Outlier 1155.00		NIST
Inp	1121.00		NIST
Inp	1120.00		NIST
Inp	1122.00		NIST
Inp	1117.00		NIST
Inp	1117.00		NIST
Inp	1111.00		NIST
Inp	1118.00		NIST
Inp	1116.00		NIST
Inp	1116.00		NIST
Inp	1121.00		NIST
Inp	1119.00		NIST
Inp	1120.00		NIST
Inp	1122.00		NIST
Inp	1123.00		NIST
Inp	1124.00		NIST
Inp	1116.00		NIST
Inp	1110.00		NIST
Inp	1141.00		NIST
Inp	1116.00		NIST
Inp	1122.00		NIST
Inp	1141.00		NIST
I	[1648.00; 1665.00]
I	1648.00		NIST
I	1656.00		NIST
I	1665.00		NIST
Tboil	475.42	K	Relay (1.0) Calculated Property
Tc	685.37	K	Relay (1.0) Calculated Property
Tfus	269.67	K	Relay (1.0) Calculated Property
Vc	0.439	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[159.21; 401.63]	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			-3.43890e+01
Coefficient B			8.47720e-01
Coefficient C			-5.43600e-04
Coefficient D			1.31900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	159.21	J/mol×K	273.00	Calculated Property
Cp,gas	203.32	J/mol×K	353.78	Calculated Property
Cp,gas	242.16	J/mol×K	434.56	Calculated Property
Cp,gas	276.16	J/mol×K	515.33	Calculated Property
Cp,gas	305.72	J/mol×K	596.11	Calculated Property
Cp,gas	331.26	J/mol×K	676.89	Calculated Property
Cp,gas	353.21	J/mol×K	757.67	Calculated Property
Cp,gas	371.98	J/mol×K	838.44	Calculated Property
Cp,gas	387.98	J/mol×K	919.22	Calculated Property
Cp,gas	401.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[354.82; 513.98]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.41863e+01
Coefficient B			-3.90777e+03
Coefficient C			-7.36590e+01
Temperature range, min.			354.82
Temperature range, max.			513.98
Pvap	1.33	kPa	354.82	Calculated Property
Pvap	3.03	kPa	372.50	Calculated Property
Pvap	6.30	kPa	390.19	Calculated Property
Pvap	12.11	kPa	407.87	Calculated Property
Pvap	21.79	kPa	425.56	Calculated Property
Pvap	37.07	kPa	443.24	Calculated Property
Pvap	60.08	kPa	460.93	Calculated Property
Pvap	93.35	kPa	478.61	Calculated Property
Pvap	139.78	kPa	496.30	Calculated Property
Pvap	202.64	kPa	513.98	Calculated Property

Similar Compounds

Find more compounds similar to Dextroamphetamine.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• The Vaporization Enthalpy and Vapor Pressure of (d)-Amphetamine and of Several Primary Amines Used as Standards at T/K = 298 As Evaluated by Correlation Gas Chromatography and Transpiration
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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