CAS
62871-09-4 Purity
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62871-09-4 Purity
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Specification
The molecular formula is C6H6F2N2O2.
The molecular weight is 176.12 g/mol.
Some synonyms include 3-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID and 5-(difluoromethyl)-2-methylpyrazole-3-carboxylic acid.
The InChIKey is AAHYTWRSQZFZCM-UHFFFAOYSA-N.
The compound has 1 hydrogen bond donor count.
The topological polar surface area is 55.1Ų.
Yes, the compound is canonicalized.
The compound has 0 defined atom stereocenters.
The XLogP3-AA is 0.7.
The formal charge of the compound is 0.