Chemical Properties of 1H-Pyrazole, 5-methoxy-1,3-dimethyl- (CAS 53091-80-8)

InChI

InChI=1S/C6H10N2O/c1-5-4-6(9-3)8(2)7-5/h4H,1-3H3

InChI Key

QGVNQBGVRVIBMA-UHFFFAOYSA-N

Formula

C6H10N2O

SMILES

COc1cc(C)nn1C

Molecular Weight¹

126.16

CAS

53091-80-8

Other Names

• Pyrazole, 1,3-dimethyl-5-methoxy

• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
logPoct/wat	0.737		Crippen Calculated Property
McVol	101.770	ml/mol	McGowan Calculated Property
I	[1103.00; 1103.00]
I	1103.00		NIST
I	1103.00		NIST

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Similar Compounds

Find more compounds similar to 1H-Pyrazole, 5-methoxy-1,3-dimethyl-.

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
• McGowan Method
• NIST Webbook

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