Chemical Properties of Fenarimol (CAS 60168-88-9)

InChI

InChI=1S/C17H12Cl2N2O/c18-14-7-5-12(6-8-14)17(22,13-9-20-11-21-10-13)15-3-1-2-4-16(15)19/h1-11,22H

InChI Key

NHOWDZOIZKMVAI-UHFFFAOYSA-N

Formula

C17H12Cl2N2O

SMILES

OC(c1ccc(Cl)cc1)(c1cncnc1)c1ccccc1Cl

Molecular Weight¹

331.20

CAS

60168-88-9

Other Names

• (2-Chlorophenyl)-«alpha»-(4-chlorophenyl)-5-pyrimidinemethanol
• (2-chlorophenyl)-(4-chlorophenyl)-pyrimidin-5-ylmethanol
• 2,4'-dichloro-«alpha»(pyrimidin-5-yl)benzhydryl alcohol
• 5-Pyrimidinemethanol, «alpha»-(2-chlorophenyl)-«alpha»-(4-chlorophenyl)-
• BLOC
• EL 222
• Rimidin
• Rubigan
• «alpha»-(2-Chlorophenyl)-«alpha»-(4-chlorophenyl)-5-pyrimidinemethanol

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	[-4.38; -4.38]
log10WS	-4.38		Aq. Solubility Prediction
log10WS	-4.38		Estimated Solubility
logPoct/wat	4.068		Crippen Calculated Property
McVol	229.420	ml/mol	McGowan Calculated Property
Inp	[2561.00; 2602.00]
Inp	2574.00		NIST
Inp	2602.00		NIST
Inp	2602.00		NIST
Inp	2561.00		NIST
Inp	2602.00		NIST
Inp	2574.00		NIST
Tfus	375.33	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Fenarimol.

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
• Aqueous Solubility Prediction Method
• Estimated Solubility 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.
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