2-(2,4,5,7-Tetrabromo-3,6-dihydroxyxanthen-9-yl)benzoic acid,zirconium salt

CAS

94021-89-3

Catalog Number

ACM94021893

Category

Other Products

Molecular Weight

2686.817840 [g/mol]

Molecular Formula

C80H36Br16O20Zr

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 301-481-2, 2-(2,4,5,7-Tetrabromo-3,6-dihydroxyxanthen-9-yl)benzoic acid, zirconium salt, 94021-89-3

IUPAC Name

2-(2,4,5,7-tetrabromo-3,6-dihydroxy-9H-xanthen-9-yl)benzoate; zirconium(4+)

Canonical SMILES

C1=CC=C(C(=C1)C2C3=CC(=C(C(=C3OC4=C(C(=C(C=C24)Br)O)Br)Br)O)Br)C(=O)[O-].C1=CC=C(C(=C1)C2C3=CC(=C(C(=C3OC4=C(C(=C(C=C24)Br)O)Br)Br)O)Br)C(=O)[O-].C1=CC=C(C(=C1)C2C3=CC(=C(C(=C3OC4=C(C(=C(C=C24)Br)O)Br)Br)O)Br)C(=O)[O-].C1=CC=C(C(=C1)C2C3=CC(=C(C(=C3OC4=C(C(=C(C=C24)Br)O)Br)Br)O)Br)C(=O)[O-].[Zr+4]

InChI Key

LOVRHALAUNWXST-UHFFFAOYSA-J

EC Number

301-481-2

Exact Mass

2668.78000

H-Bond Acceptor

H-Bond Donor