U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C21H18O5S
Molecular Weight 382.43
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CRESOL PURPLE

SMILES

CC1=CC(O)=CC=C1C2(OS(=O)(=O)C3=CC=CC=C23)C4=CC=C(O)C=C4C

InChI

InChIKey=OLQIKGSZDTXODA-UHFFFAOYSA-N
InChI=1S/C21H18O5S/c1-13-11-15(22)7-9-17(13)21(18-10-8-16(23)12-14(18)2)19-5-3-4-6-20(19)27(24,25)26-21/h3-12,22-23H,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H18O5S
Molecular Weight 382.43
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:42:14 GMT 2025
Edited
by admin
on Mon Mar 31 18:42:14 GMT 2025
Record UNII
85ODZ58K3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CRESOL PURPLE
MI  
Common Name English
NSC-9607
Preferred Name English
PHENOL, 4,4'-(1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS(3-METHYL-
Systematic Name English
CRESOL PURPLE [MI]
Common Name English
M-CRESOLSULFONPHTHALEIN
Common Name English
4,4'-(1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS(3-METHYLPHENOL)
Systematic Name English
METACRESOL PURPLE
Common Name English
M-CRESOL PURPLE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID3062316
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
MERCK INDEX
m3837
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY Merck Index
WIKIPEDIA
Metacresol purple
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
FDA UNII
85ODZ58K3D
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
NSC
9607
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
SMS_ID
300000051218
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
PUBCHEM
73030
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-960-6
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
MESH
C039339
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY
CAS
2303-01-7
Created by admin on Mon Mar 31 18:42:14 GMT 2025 , Edited by admin on Mon Mar 31 18:42:14 GMT 2025
PRIMARY