Analyte Name

5-Bromo-3-methylpicolinic Acid

CAS Number

886365-43-1

Molecular Formula

C44 H36 N6 O3

Molecular Weight

696.795

Accurate Mass

696.285

SMILES

CCOc1nc2c(cccc2n1Cc3ccc(cc3)c4ccccc4c5nnn(n5)C(c6ccccc6)(c7ccccc7)c8ccccc8)C(=O)OC

InChI

InChI=1S/C44H36N6O3/c1-3-53-43-45-40-38(42(51)52-2)24-15-25-39(40)49(43)30-31-26-28-32(29-27-31)36-22-13-14-23-37(36)41-46-48-50(47-41)44(33-16-7-4-8-17-33,34-18-9-5-10-19-34)35-20-11-6-12-21-35/h4-29H,3,30H2,1-2H3

IUPAC

methyl 2-ethoxy-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat