Products 1217612-80-0

CAS 1217612-80-0 is the registry number for cis-Atovaquone-d5 (contains 10% trans isomer). Offered by: TRC, MedChemExpress. Available pack sizes: 0,5mg, 5mg, 5 mg, 1 mg, 500 μg.

cis-Atovaquone-d5 (contains 10% trans isomer)
TRC, MedChemExpress
  • size: 0,5mg, 5mg, 5 mg, 1 mg
  • Variants: 5
from 3082.87
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Structural formula: {0} (CAS {1})

3-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuteriocyclohexyl]-4-hydroxynaphthalene-1,2-dione (CAS 1217612-80-0) is a chemical compound with the molecular formula C22H19ClO3 and a molecular weight of 371.9 g/mol. IUPAC name: 3-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuteriocyclohexyl]-4-hydroxynaphthalene-1,2-dione. InChIKey: BSJMWHQBCZFXBR-YNUDWXFUSA-N.

Identity
Molecular formulaC22H19ClO3
Molecular weight371.9 g/mol
IUPAC name3-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuteriocyclohexyl]-4-hydroxynaphthalene-1,2-dione
InChIKeyBSJMWHQBCZFXBR-YNUDWXFUSA-N
SMILES[2H]C1(CC(CC(C1([2H])C2=C(C3=CC=CC=C3C(=O)C2=O)O)([2H])[2H])C4=CC=C(C=C4)Cl)[2H]

Computed by PubChem (NCBI)

Synonyms: Atovaquone-d5, cis-Atovaquone-d5 (contains 10% trans isomer), cis-Atovaquone-d5 (contains 10per cent trans isomer), cis-2-[4-(4-Chlorophenyl)cyclohexyl-d5-]-3-hydroxy-1,4-naphthalenedione-d5
Related forms of this compound
3-[4-(4-chlorophenyl)cyclohexyl]-4-hydroxynaphthalene-1,2-dione C22H19ClO3
3-[4-(4-chlorophenyl)cyclohexyl]-4-hydroxynaphthalene-1,2-dione C22H19ClO3
3-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuteriocyclohexyl]-4-hydroxynaphthalene-1,2-dione C22H19ClO3
3-[4-(4-chloro-2,3,5,6-tetradeuteriophenyl)cyclohexyl]-4-hydroxynaphthalene-1,2-dione C22H19ClO3