Chemical Properties of Tyramine, N-formyl- (CAS 13062-78-7)

InChI

InChI=1S/C9H11NO2/c11-7-10-6-5-8-1-3-9(12)4-2-8/h1-4,7,12H,5-6H2,(H,10,11)

InChI Key

ZRAJFHFOIYKZPF-UHFFFAOYSA-N

Formula

C9H11NO2

SMILES

OC=NCCc1ccc(O)cc1

Molecular Weight¹

165.19

CAS

13062-78-7

Other Names

• N-Formyltyramine

• Δ_fH°_gas : Enthalpy of formation 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-239.88	kJ/mol	Joback Calculated Property
ΔvapH°	70.91	kJ/mol	Joback Calculated Property
log10WS	-1.22		Crippen Calculated Property
logPoct/wat	1.521		Crippen Calculated Property
McVol	131.330	ml/mol	McGowan Calculated Property
Pc	3834.03	kPa	Joback Calculated Property
Inp	[1882.10; 1882.10]
Inp	1882.10		NIST
Inp	1882.10		NIST
Tboil	681.48	K	Joback Calculated Property
Tc	901.55	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tyramine, N-formyl-.

Sources

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

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