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CHEBI:86218 - cresol red
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ChEBI Name
cresol red
ChEBI ID
CHEBI:86218
Definition
A member of the class of 2,1-benzoxathioles that is 2,1-benzoxathiole 1,1-dioxide in which both of the hydrogens at position 3 have been substituted by 4-hydroxy-5-methylphenyl groups.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C21H18O5S
Net Charge
0
Average Mass
382.43000
Monoisotopic Mass
382.08749
InChI
InChI=1S/C21H18O5S/c1-
13-
11-
15(7-
9-
18(13)
22)
21(16-
8-
10-
19(23)
14(2)
12-
16)
17-
5-
3-
4-
6-
20(17)
27(24,25)
26-
21/h3-
12,22-
23H,1-
2H3
InChIKey
OBRMNDMBJQTZHV-UHFFFAOYSA-N
SMILES
Cc1cc(ccc1O)C1(OS(=O)(=O)c2ccccc12)c1ccc(O)c(C)c1
Roles Classification
Application
(s):
acid-base indicator
An acid or base which exhibits a colour change on neutralization by the basic or acidic titrant at or near the equivalence point of a titration.
dye
two-colour indicator
A colour indicator that possesses a different colour on each side of the transition interval.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cresol red (
CHEBI:86218
)
has role
acid-base indicator (
CHEBI:50407
)
cresol red (
CHEBI:86218
)
has role
dye (
CHEBI:37958
)
cresol red (
CHEBI:86218
)
has role
two-colour indicator (
CHEBI:50412
)
cresol red (
CHEBI:86218
)
is a
2,1-benzoxathiole (
CHEBI:38087
)
cresol red (
CHEBI:86218
)
is a
arenesulfonate ester (
CHEBI:38094
)
cresol red (
CHEBI:86218
)
is a
polyphenol (
CHEBI:26195
)
cresol red (
CHEBI:86218
)
is a
sultone (
CHEBI:38088
)
IUPAC Name
3,3-
bis(4-
hydroxy-
5-
methylphenyl)-
2,1λ
6
-
benzoxathiole-
1,1(3
H
)-
dione
Synonyms
Sources
3',3''-Dimethylphenolsulfonephthalein
ChemIDplus
Cresolsulfophthalein
ChemIDplus
NSC 7224
ChemIDplus
o-Cresol Red
ChemIDplus
o-Cresolsulfonephthalein
ChemIDplus
Manual Xref
Database
Cresol_Red
Wikipedia
View more database links
Registry Numbers
Types
Sources
1733-12-6
CAS Registry Number
ChemIDplus
343399
Reaxys Registry Number
Reaxys
Citation
Type
Source
26003703
PubMed citation
Europe PMC
Last Modified
29 June 2015