CAS
92500-17-9 Purity
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92500-17-9 Purity
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Specification
The molecular formula is C14H19NO4.
It was first created in PubChem on July 19, 2005.
The IUPAC name is diethyl 2-(2-pyridin-4-ylethyl)propanedioate.
The molecular weight is 265.30 g/mol.
The InChI is InChI=1S/C14H19NO4/c1-3-18-13(16)12(14(17)19-4-2)6-5-11-7-9-15-10-8-11/h7-10,12H,3-6H2,1-2H3.
It has 5 hydrogen bond acceptor counts.
The topological polar surface area is 65.5 Ų.
It has 9 rotatable bond counts.
Yes, the compound is canonicalized in PubChem.
The XLogP3-AA value is 2.1.