Chemical Properties of Cinnarizine (CAS 298-57-7)

InChI

InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-17,26H,18-22H2/b13-10+

InChI Key

DERZBLKQOCDDDZ-JLHYYAGUSA-N

Formula

C26H28N2

SMILES

C(=Cc1ccccc1)CN1CCN(C(c2ccccc2)c2ccccc2)CC1

Molecular Weight¹

368.51

CAS

298-57-7

Other Names

• 1-Benzhydryl-4-cinnamylpiperazine
• 1-Cinnamyl-4-(diphenylmethyl)piperazine
• 516 MD
• Aplactan
• Aplexal
• Apotomin
• Artate
• Carecin
• Cerebolan
• Cerepar
• Cinaperazine
• Cinarizine
• Cinazyn
• Cinnacet
• Cinnageron
• Corathiem
• Denapol
• Dimitron
• Dimitronal
• Eglen
• Folcodal
• Giganten
• Glanil
• Hilactan
• Ixertol
• Katoseran
• Labyrin
• Lazeta
• Marisan
• Midronal
• Mitronal
• Olamin
• Piperazine, 1-(diphenylmethyl)-4-(3-phenyl-2-propenyl)-
• Piperazine, 1-cinnamyl-4-(diphenylmethyl)-
• Processine
• R 1575
• R 516
• Sedatromin
• Sepan
• Siptazin
• Spaderizine
• Stugeron
• Stutgeron
• Stutgin
• Toliman
• piperazine, 1-(diphenylmethyl)-4-(3-phenyl-2-propen-1-yl)-

• ω : Acentric Factor.
• 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	0.5940		Relay (1.0) Calculated Property
ΔfG°	620.40	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	445.96	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	37.13	kJ/mol	Solubility and Caloric Properties of Cinnarizine
ΔvapH°	127.03	kJ/mol	Relay (1.0) Calculated Property
IE	8.02	eV	Relay (1.0) Calculated Property
log10WS	-4.28		Relay (1.0) Calculated Property
logPoct/wat	5.107		Crippen Calculated Property
McVol	310.720	ml/mol	McGowan Calculated Property
Pc	1523.53	kPa	Relay (1.0-beta) Calculated Property
Inp	[3010.00; 3070.00]
Inp	3052.00		NIST
Inp	3055.00		NIST
Inp	3040.00		NIST
Inp	Outlier 3010.00		NIST
Inp	3070.00		NIST
Inp	3040.00		NIST
Inp	3065.00		NIST
Inp	3040.00		NIST
Tboil	729.38	K	Relay (1.0) Calculated Property
Tc	1016.60	K	Relay (1.0) Calculated Property
Tfus	395.10	K	Measurement and correlation for the solubilities of cinnarizine, pentoxifylline, and piracetam in supercritical carbon dioxide
Vc	1.090	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Cinnarizine.

Mixtures

• Carbon dioxide + Cinnarizine
• Acetonitrile + Cinnarizine
• 1-Butanol + Cinnarizine
• Acetic acid, butyl ester + Cinnarizine
• Isopropyl Alcohol + Cinnarizine
• Cinnarizine + Water

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Measurement and correlation for the solubilities of cinnarizine, pentoxifylline, and piracetam in supercritical carbon dioxide
• Solubility and Caloric Properties of Cinnarizine
• 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.