Chemical Properties of 2-Propenethioamide, 2-cyano-3-phenyl-, (E)- (CAS 68029-52-7)

InChI

InChI=1S/C10H8N2S/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-6H,(H2,12,13)/b9-6+

InChI Key

DFVRLZLNOKWNEH-RMKNXTFCSA-N

Formula

C10H8N2S

SMILES

N#CC(=Cc1ccccc1)C(=N)S

Molecular Weight¹

188.25

CAS

68029-52-7

• 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_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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[45.79; 343.63]	J/mol×K	[100.12; 708.20]
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	45.79	J/mol×K	100.12	Joback Calculated Property
Cp,gas	343.63	J/mol×K	708.20	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Propenethioamide, 2-cyano-3-phenyl-, (E)-.

Sources

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

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