Bromocresol purple sodium
Properties
- Molecular formula
- C21H15Br2NaO5S
- Molar mass
- 562.20 g/mol
- Exact mass
- 559.8905 Da
- logP
- 4.87Crippen estimate
- Polar surface area
- 83.8 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 2
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
62625-30-3SMILES
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc23)cc(Br)c1[O-].[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1)
- Phenol, 4,4′-(3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, S,S-dioxide, monosodium salt
- Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, monosodium salt
- 3H-2,1-Benzoxathiole, phenol deriv.
Work with Bromocresol purple sodium
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Bromophenol blue sodium salt33551-92-780 % similar
Eriochrome cyanine R3564-18-966 % similar
Bromophenol blue115-39-966 % similar
Bromochlorophenol blue2553-71-159 % similar
Cresol red sodium62625-29-056 % similar
Bromophenol red2800-80-855 % similar
Xylenol orange tetrasodium salt3618-43-755 % similar
Bromocresol green76-60-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.