CAS
902837-53-0 Purity
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902837-53-0 Purity
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Specification
The molecular formula is C5H5ClN2O.
The molecular weight is 144.56 g/mol.
The IUPAC name is 4-chloro-2-methylpyrazole-3-carbaldehyde.
The InChI is InChI=1S/C5H5ClN2O/c1-8-5(3-9)4(6)2-7-8/h2-3H,1H3.
The InChIKey is JGARVIIOTXNVGP-UHFFFAOYSA-N.
The canonical SMILES is CN1C(=C(C=N1)Cl)C=O.
The CAS number is 902837-61-0.
The molecular weight is 144.56 g/mol.
The XLogP3-AA value is 0.7.
Yes, it is a canonicalized compound according to PubChem.