1314-28-9 Purity
96%
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Specification
The molecular formula of DCJT is C27H29N3O.
The PubChem CID of DCJT is 23110323.
The molecular weight of DCJT is 411.5 g/mol.
The IUPAC name of DCJT is 2-[2-methyl-6-[(E)-2-(4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)ethenyl]pyran-4-ylidene]propanedinitrile.
The InChIKey of DCJT is DTZWGKCFKSJGPK-VOTSOKGWSA-N.
The canonical SMILES of DCJT is CC1=CC(=C(C#N)C#N)C=C(O1)C=CC2=CC3=C4C(=C2)C(CCN4CCC3(C)C)(C)C.
DCJT has 4 hydrogen bond acceptor counts.
The topological polar surface area of DCJT is 60 ?2.
DCJT has 2 rotatable bond counts.
Yes, DCJT has 1 defined bond stereocenter count.