CAS
950603-21-1 Purity
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950603-21-1 Purity
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1-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxylic acid
CAS
950603-35-7
Catalog Number
ACM950603357
Category
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Specification
Synonyms
1-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxylic acid
What is the molecular formula of the compound with PubChem CID 33589561?
The molecular formula is C9H10F3N3O2S.
When was this compound created in PubChem?
It was created on May 29, 2009.
What is the computed molecular weight of the compound?
The molecular weight is 281.26 g/mol.
What is the InChIKey of the compound?
The InChIKey is PWQMNLMMMCREOV-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.8.
How many hydrogen bond acceptor counts does the compound have?
The compound has 9 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 94.6 Ų.
How many rotatable bond counts does the compound have?
The compound has 2 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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