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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=C(C=CC(O)=C1)C2(OS(=O)(=O)C3=C2C=CC=C3)C4=C(C)C=C(O)C=C4

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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Substance Class Chemical
Record UNII
85ODZ58K3D
Record Status Validated (UNII)
Record Version