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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H20O4
Molecular Weight 348.3918
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-BIS(4-ETHYLPHENYL)-3,6-DIHYDROXYBENZO-1,4-QUINONE

SMILES

CCC1=CC=C(C=C1)C2=C(O)C(=O)C(=C(O)C2=O)C3=CC=C(CC)C=C3

InChI

InChIKey=JTTAVDAEVCLLLX-UHFFFAOYSA-N
InChI=1S/C22H20O4/c1-3-13-5-9-15(10-6-13)17-19(23)21(25)18(22(26)20(17)24)16-11-7-14(4-2)8-12-16/h5-12,23,26H,3-4H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-114126
Preferred Name English
2,5-BIS(4-ETHYLPHENYL)-3,6-DIHYDROXYBENZO-1,4-QUINONE
Systematic Name English
2,5-CYCLOHEXADIENE-1,4-DIONE, 2,5-BIS(4-ETHYLPHENYL)-3,6-DIHYDROXY-
Systematic Name English
P-BENZOQUINONE, 2,5-BIS(P-ETHYLPHENYL)-3,6-DIHYDROXY-
Systematic Name English
Code System Code Type Description
FDA UNII
52A4VA7G1E
Created by admin on Tue Apr 01 19:55:31 GMT 2025 , Edited by admin on Tue Apr 01 19:55:31 GMT 2025
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PUBCHEM
270944
Created by admin on Tue Apr 01 19:55:31 GMT 2025 , Edited by admin on Tue Apr 01 19:55:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID50179614
Created by admin on Tue Apr 01 19:55:31 GMT 2025 , Edited by admin on Tue Apr 01 19:55:31 GMT 2025
PRIMARY
CAS
24909-18-0
Created by admin on Tue Apr 01 19:55:31 GMT 2025 , Edited by admin on Tue Apr 01 19:55:31 GMT 2025
PRIMARY
NSC
114126
Created by admin on Tue Apr 01 19:55:31 GMT 2025 , Edited by admin on Tue Apr 01 19:55:31 GMT 2025
PRIMARY