Chlorophenol red

C19H12Cl2O5SCAS 4430-20-0423.26 g/mol

OSOOOHClHOCl
Aryl halidePhenolSulfonate ester

Properties

Molecular formula
C19H12Cl2O5S
Molar mass
423.26 g/mol
Exact mass
421.9783 Da
Melting point
261–262 °C
logP
4.42Crippen estimate
Polar surface area
83.8 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 49 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
4430-20-0
SMILES
O=S1(=O)OC(c2ccc(O)c(Cl)c2)(c2ccc(O)c(Cl)c2)c2ccccc21
InChIKey
WWAABJGNHFGXSJ-UHFFFAOYSA-N
InChI
InChI=1S/C19H12Cl2O5S/c20-14-9-11(5-7-16(14)22)19(12-6-8-17(23)15(21)10-12)13-3-1-2-4-18(13)27(24,25)26-19/h1-10,22-23H

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Names and synonyms

9 names
  • Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-chloro-
  • Phenol, 4,4′-(3H-2,1-benzoxathiol-3-ylidene)bis[2-chloro-, S,S-dioxide
  • o-Toluenesulfonic acid, α,α-bis(3-chloro-4-hydroxyphenyl)-α-hydroxy-, γ-sultone
  • 3H-2,1-Benzoxathiole, phenol deriv.
  • 4,4′-(1,1-Dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-chlorophenol]
  • Chlorphenol red
  • Dichlorophenolsulfonephthalein
  • Chlorphenolsulfonphthalein
  • NSC 7828

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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