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Details

Stereochemistry RACEMIC
Molecular Formula C24H30O2
Molecular Weight 350.4938
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,7-DI-TERT-BUTYL-3-(2,3-DIMETHYLPHENYL)-2(3H)-BENZOFURANONE

SMILES

CC1=C(C)C(=CC=C1)C2C(=O)OC3=C(C=C(C=C23)C(C)(C)C)C(C)(C)C

InChI

InChIKey=JFYKXFLSIZYLRY-UHFFFAOYSA-N
InChI=1S/C24H30O2/c1-14-10-9-11-17(15(14)2)20-18-12-16(23(3,4)5)13-19(24(6,7)8)21(18)26-22(20)25/h9-13,20H,1-8H3

HIDE SMILES / InChI

Molecular Formula C24H30O2
Molecular Weight 350.4938
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:56:29 GMT 2025
Edited
by admin
on Mon Mar 31 21:56:29 GMT 2025
Record UNII
W6591B3O5O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2(3H)-BENZOFURANONE, 5,7-BIS(1,1-DIMETHYLETHYL)-3-(2,3-DIMETHYLPHENYL)-
Preferred Name English
5,7-DI-TERT-BUTYL-3-(2,3-DIMETHYLPHENYL)-2(3H)-BENZOFURANONE
Systematic Name English
5,7-BIS(TERT-BUTYL)-3-(2,3-DIMETHYLPHENYL)-3H-BENZOFURAN-2-ONE
Systematic Name English
5,7-DI-TERT-BUTYL-3-(2,3-DIMETHYLPHENYL)-3H-BENZOFURAN-2-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10889060
Created by admin on Mon Mar 31 21:56:29 GMT 2025 , Edited by admin on Mon Mar 31 21:56:29 GMT 2025
PRIMARY
CAS
169198-26-9
Created by admin on Mon Mar 31 21:56:29 GMT 2025 , Edited by admin on Mon Mar 31 21:56:29 GMT 2025
PRIMARY
FDA UNII
W6591B3O5O
Created by admin on Mon Mar 31 21:56:29 GMT 2025 , Edited by admin on Mon Mar 31 21:56:29 GMT 2025
PRIMARY
PUBCHEM
9798510
Created by admin on Mon Mar 31 21:56:29 GMT 2025 , Edited by admin on Mon Mar 31 21:56:29 GMT 2025
PRIMARY