Products 62625-21-2

CAS 62625-21-2 appears in our catalog under these names: Thymol Blue (sodium), Thymol Blue sodium salt, 0.04% w/v aq. soln. , Thymol Blue sodium salt, ACS , Thymol Blue sodium salt , Thymol Blue Sodium Salt. Offered by: GLPBio, Thermo Scientific (Alfa Aesar), TCI, Biosynth, Thermo Scientific (Acros). Available pack sizes: 100g, 100ml, 500ml, 10g, 50g, 250g, 1g, 25g.

Structural formula: {0} (CAS {1})

Sodium 4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1lambda6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolate (CAS 62625-21-2) is a chemical compound with the molecular formula C27H29NaO5S and a molecular weight of 488.6 g/mol. IUPAC name: sodium 4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1lambda6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolate. InChIKey: BAVBEHWEOJMHDS-UHFFFAOYSA-M.

Identity
Molecular formulaC27H29NaO5S
Molecular weight488.6 g/mol
IUPAC namesodium 4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1lambda6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolate
InChIKeyBAVBEHWEOJMHDS-UHFFFAOYSA-M
SMILESCC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)[O-])C(C)C)C(C)C)O.[Na+]

Computed by PubChem (NCBI)