Chemical Properties of Mephedrone M (Ar-CH2OH, nor), 2Ac

InChI

InChI=1S/C14H17NO4/c1-9(15-10(2)16)14(18)13-6-4-12(5-7-13)8-19-11(3)17/h4-7,9H,8H2,1-3H3,(H,15,16)

InChI Key

PACJGKJARDXWGO-UHFFFAOYSA-N

Formula

C14H17NO4

SMILES

CC(=O)NC(C)C(=O)c1ccc(COC(C)=O)cc1

Molecular Weight¹

263.29

• 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).
• 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	0.7148		Relay (1.0) Calculated Property
ΔfG°	-235.03	kJ/mol	Joback Calculated Property
ΔfH°gas	-667.32	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.23	kJ/mol	Joback Calculated Property
ΔvapH°	93.80	kJ/mol	Relay (1.0) Calculated Property
IE	8.57	eV	Relay (1.0) Calculated Property
log10WS	-2.02		Relay (1.0) Calculated Property
logPoct/wat	1.457		Crippen Calculated Property
McVol	204.920	ml/mol	McGowan Calculated Property
Pc	2372.59	kPa	Joback Calculated Property
Inp	[2310.00; 2310.00]
Inp	2310.00		NIST
Inp	2310.00		NIST
Tboil	595.33	K	Relay (1.0) Calculated Property
Tc	829.89	K	Relay (1.0) Calculated Property
Tfus	367.26	K	Relay (1.0) Calculated Property
Vc	0.735	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[581.78; 643.53]	J/mol×K	[785.14; 1002.42]
Cp,gas	581.78	J/mol×K	785.14	Joback Calculated Property
Cp,gas	594.48	J/mol×K	821.35	Joback Calculated Property
Cp,gas	606.19	J/mol×K	857.57	Joback Calculated Property
Cp,gas	616.92	J/mol×K	893.78	Joback Calculated Property
Cp,gas	626.70	J/mol×K	929.99	Joback Calculated Property
Cp,gas	635.56	J/mol×K	966.21	Joback Calculated Property
Cp,gas	643.53	J/mol×K	1002.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to Mephedrone M (Ar-CH2OH, nor), 2Ac.

Sources

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

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