Chemical Properties of Propyphenazone (CAS 479-92-5)

InChI

InChI=1S/C14H18N2O/c1-10(2)13-11(3)15(4)16(14(13)17)12-8-6-5-7-9-12/h5-10H,1-4H3

InChI Key

PXWLVJLKJGVOKE-UHFFFAOYSA-N

Formula

C14H18N2O

SMILES

Cc1c(C(C)C)c(=O)n(-c2ccccc2)n1C

Molecular Weight¹

230.31

CAS

479-92-5

Other Names

• 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-4-(1-methylethyl)-2-phenyl-
• Antipyrine, 4-isopropyl-
• 2,3-Dimethyl-4-isopropyl-1-phenyl-3H-pyrazolin-5-one
• Isopropylantipyrin
• Isopropylantipyrine
• 4-Isopropylantipyrine
• 4-Isopropyl-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one
• Isopropylphenazone
• Larodon
• 1-Phenyl-2,3-dimethyl-4-isopropyl-3-pyrazolin-5-one
• 1-Phenyl-2,3-dimethyl-4-isopropylpyrazol-5-one
• 3-Pyrazolin-5-one, 2,3-dimethyl-4-isopropyl-1-phenyl-
• 3-Pyrazolin-5-one, 4-isopropyl-2,3-dimethyl-1-phenyl-
• Isopropyrine
• 4-Isopropylphenazone
• Budirol
• Causyth
• Cibalgina
• Eufibron
• Isopropchin

• 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.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-5.49		Crippen Calculated Property
logPoct/wat	2.608		Crippen Calculated Property
McVol	190.730	ml/mol	McGowan Calculated Property
Inp	[1917.00; 1925.00]
Inp	1925.00		NIST
Inp	1917.00		NIST
Inp	1925.00		NIST
Inp	1925.00		NIST
Inp	1917.00		NIST

Similar Compounds

Find more compounds similar to Propyphenazone.

Sources

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

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