D6808

cas: 3029240-84-1 — see every product listed under this CAS number, including other names

D6808 (CAS 3029240-84-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas3029240-84-1
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Structural formula: {0} (CAS {1})

13-(trifluoromethyl)-4,5,10,20,27,32-hexazahexacyclo[21.5.3.212,15.12,5.116,20.026,30]pentatriaconta-1(28),2(35),3,12,14,16(32),17,23(31),24,26,29,33-dodecaene-11,19-dione (CAS 3029240-84-1) is a chemical compound with the molecular formula C30H25F3N6O2 and a molecular weight of 558.6 g/mol. IUPAC name: 13-(trifluoromethyl)-4,5,10,20,27,32-hexazahexacyclo[21.5.3.212,15.12,5.116,20.026,30]pentatriaconta-1(28),2(35),3,12,14,16(32),17,23(31),24,26,29,33-dodecaene-11,19-dione. InChIKey: PQNIGFMNUHDZKX-UHFFFAOYSA-N.

Identity
Molecular formulaC30H25F3N6O2
Molecular weight558.6 g/mol
IUPAC name13-(trifluoromethyl)-4,5,10,20,27,32-hexazahexacyclo[21.5.3.212,15.12,5.116,20.026,30]pentatriaconta-1(28),2(35),3,12,14,16(32),17,23(31),24,26,29,33-dodecaene-11,19-dione
InChIKeyPQNIGFMNUHDZKX-UHFFFAOYSA-N
SMILESC1CCN2C=C(C=N2)C3=CN=C4C=CC(=CC4=C3)CCN5C(=O)C=CC(=N5)C6=CC(=C(C=C6)C(=O)NC1)C(F)(F)F

Computed by PubChem (NCBI)

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