Thymol blue sodium salt
Properties
- Molecular formula
- C27H29NaO5S
- Molar mass
- 488.57 g/mol
- Exact mass
- 488.1633 Da
- logP
- 5.59Crippen estimate
- Polar surface area
- 83.8 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 4
Identifiers
CAS number
62625-21-2SMILES
Cc1cc([O-])c(C(C)C)cc1C1(c2cc(C(C)C)c(O)cc2C)OS(=O)(=O)c2ccccc12.[Na+]InChIKey
HVGAACYQDSQPEM-UHFFFAOYSA-NInChI
InChI=1S/C27H30O5S.Na/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6;/h7-16,28-29H,1-6H3;Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, sodium salt (1:1)
- Phenol, 4,4′-(3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, S,S-dioxide, monosodium salt
- Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, monosodium salt
- 3H-2,1-Benzoxathiole, phenol deriv.
- Thymol blue monosodium salt
Work with Thymol blue sodium salt
Similar compounds
Thymol blue76-61-981 % similar
Xylenol blue125-31-561 % similar
Cresol red sodium62625-29-058 % similar
Bromthymol blue sodium34722-90-255 % similar
Bromothymol blue76-59-552 % similar
Metacresol purple2303-01-750 % similar
Thymolphthalein125-20-249 % similar
Cresol red1733-12-649 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds