Chemical Properties of 4-Cl-pyrazole (CAS 15965-31-8)

InChI

InChI=1S/C3H3ClN2/c4-3-1-5-2-6-3/h1-2H,(H,5,6)

InChI Key

BQRBAXFOPZRMCU-UHFFFAOYSA-N

Formula

C3H3ClN2

SMILES

Clc1cnc[nH]1

Molecular Weight¹

102.52

CAS

15965-31-8

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Similar Compounds

Find more compounds similar to 4-Cl-pyrazole.

Sources

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

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