Products 406939-93-3

CAS 406939-93-3 appears in our catalog under these names: Plerixafor Impurity P, Plerixafor Impurity 27, Plerixafor Hexatrifluoroacetamide. Offered by: Chemat Brand, Hubei YoungXin, TRC. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.

Plerixafor Impurity P
Chemat Brand
  • size: on request
  • Variants: 1
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Plerixafor Impurity 27
Hubei YoungXin
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
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Plerixafor Hexatrifluoroacetamide
TRC
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-[4,8-bis(2,2,2-trifluoroacetyl)-11-[[4-[[4,8,11-tris(2,2,2-trifluoroacetyl)-1,4,8,11-tetrazacyclotetradec-1-yl]methyl]phenyl]methyl]-1,4,8,11-tetrazacyclotetradec-1-yl]-2,2,2-trifluoroethanone (CAS 406939-93-3) is a chemical compound with the molecular formula C40H48F18N8O6 and a molecular weight of 1078.8 g/mol. IUPAC name: 1-[4,8-bis(2,2,2-trifluoroacetyl)-11-[[4-[[4,8,11-tris(2,2,2-trifluoroacetyl)-1,4,8,11-tetrazacyclotetradec-1-yl]methyl]phenyl]methyl]-1,4,8,11-tetrazacyclotetradec-1-yl]-2,2,2-trifluoroethanone. InChIKey: ZLIVMLGSJBPBRC-UHFFFAOYSA-N.

Identity
Molecular formulaC40H48F18N8O6
Molecular weight1078.8 g/mol
IUPAC name1-[4,8-bis(2,2,2-trifluoroacetyl)-11-[[4-[[4,8,11-tris(2,2,2-trifluoroacetyl)-1,4,8,11-tetrazacyclotetradec-1-yl]methyl]phenyl]methyl]-1,4,8,11-tetrazacyclotetradec-1-yl]-2,2,2-trifluoroethanone
InChIKeyZLIVMLGSJBPBRC-UHFFFAOYSA-N
SMILESC1CN(CCN(CCCN(CCN(C1)C(=O)C(F)(F)F)C(=O)C(F)(F)F)C(=O)C(F)(F)F)CC2=CC=C(C=C2)CN3CCCN(CCN(CCCN(CC3)C(=O)C(F)(F)F)C(=O)C(F)(F)F)C(=O)C(F)(F)F

Computed by PubChem (NCBI)

Synonyms: Plerixafor Hexa(trifluoroacetate), Plerixafor Hexatrifluoroacetamide, Plerixafor Impurity P, Plerixafor Hexa(Trifluoroacetic Acid Salt), ZLIVMLGSJBPBRC-UHFFFAOYSA-N