Analyte Name

Thymolphthalein Monophosphate Hemimagnesium Salt

CAS Number

35106-21-9

Molecular Formula

2 C28 H30 O7 P . Mg

Molecular Weight

1043.32

Accurate Mass

1042.331

SMILES

[Mg+2].CC(C)c1cc(c(C)cc1O)C2(OC(=O)c3ccccc23)c4cc(C(C)C)c(OP(=O)(O)[O-])cc4C.CC(C)c5cc(c(C)cc5O)C6(OC(=O)c7ccccc67)c8cc(C(C)C)c(OP(=O)(O)[O-])cc8C

InChI

InChI=1S/2C28H31O7P.Mg/c2*1-15(2)20-13-23(17(5)11-25(20)29)28(22-10-8-7-9-19(22)27(30)34-28)24-14-21(16(3)4)26(12-18(24)6)35-36(31,32)33;/h2*7-16,29H,1-6H3,(H2,31,32,33);/q;;+2/p-2

IUPAC

magnesium;[4-[1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] hydrogen phosphate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat