Chemical Properties of N-Acetyltranylcypromine (CAS 78682-61-8)

InChI

InChI=1S/C11H13NO/c1-8(13)12-11-7-10(11)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)

InChI Key

OKNYZIGDRLPEEJ-UHFFFAOYSA-N

Formula

C11H13NO

SMILES

CC(=O)NC1CC1c1ccccc1

Molecular Weight¹

175.23

CAS

78682-61-8

Other Names

• Tranylcypromine acetate
• N-(2-Phenylcyclopropyl)acetamide
• Tranylcypromine, acetylated

• 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°	167.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-40.49	kJ/mol	Joback Calculated Property
ΔfusH°	24.19	kJ/mol	Joback Calculated Property
ΔvapH°	55.14	kJ/mol	Joback Calculated Property
log10WS	-2.46		Crippen Calculated Property
logPoct/wat	1.679		Crippen Calculated Property
McVol	142.780	ml/mol	McGowan Calculated Property
Pc	3191.93	kPa	Joback Calculated Property
Inp	[1636.00; 1695.00]
Inp	1695.00		NIST
Inp	1636.00		NIST
Tboil	583.87	K	Joback Calculated Property
Tc	810.97	K	Joback Calculated Property
Tfus	356.44	K	Joback Calculated Property
Vc	0.540	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[358.36; 437.06]	J/mol×K	[583.87; 810.97]
Cp,gas	358.36	J/mol×K	583.87	Joback Calculated Property
Cp,gas	374.07	J/mol×K	621.72	Joback Calculated Property
Cp,gas	388.64	J/mol×K	659.57	Joback Calculated Property
Cp,gas	402.16	J/mol×K	697.42	Joback Calculated Property
Cp,gas	414.68	J/mol×K	735.27	Joback Calculated Property
Cp,gas	426.29	J/mol×K	773.12	Joback Calculated Property
Cp,gas	437.06	J/mol×K	810.97	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-Acetyltranylcypromine.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.