93842-97-8 Purity
96%
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Specification
The molecular formula is C27H28N2O4.
Some synonyms include EINECS 299-078-9 and 1-(4-Cyanobutyl)-gamma-methyl-alpha,alpha-diphenylpyridinium hydrogen fumarate.
The molecular weight is 444.5 g/mol.
It was created on 2009-08-20 and last modified on 2023-12-30.
The InChIKey is UOHJGSPJYBKRGT-WLHGVMLRSA-N.
There are 2 hydrogen bond donor counts.
The topological polar surface area is 106 Ų.
There are 7 rotatable bond counts.
Yes, the compound is canonicalized.
The complexity value is 635.