Chemical Properties of 3-Pyrazolin-5-one, 4-butyl-1,2-diphenyl-3-methoxy- (CAS 27258-01-1)

InChI

InChI=1S/C20H22N2O2/c1-3-4-15-18-19(23)21(16-11-7-5-8-12-16)22(20(18)24-2)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3

InChI Key

HZWCYMHYZRAXMH-UHFFFAOYSA-N

Formula

C20H22N2O2

SMILES

CCCCc1c(OC)n(-c2ccccc2)n(-c2ccccc2)c1=O

Molecular Weight¹

322.40

CAS

27258-01-1

Other Names

• 4-Butyl-1,2-diphenyl-3-methoxy-3-pyrazolin-5-one
• 3-Methoxy-4-n-butyl-1,2-diphenyl-5-pyrazolone
• 3H-Pyrazol-3-one, 4-butyl-1,2-dihydro-5-methoxy-1,2-diphenyl-
• 4-Butyl-5-methoxy-1,2-diphenyl-1,2-dihydro-3H-pyrazol-3-one
• Phenyl butazone, methyl deriv.
• Phenylbutazone, methylated

• 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

Similar Compounds

Find more compounds similar to 3-Pyrazolin-5-one, 4-butyl-1,2-diphenyl-3-methoxy-.

Sources

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

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