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

Details

Stereochemistry ACHIRAL
Molecular Formula C28H42O
Molecular Weight 394.6325
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Bis(4-(1,1,3,3-tetramethylbutyl)phenyl)ether

SMILES

CC(C)(C)CC(C)(C)C1=CC=C(OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)C=C1

InChI

InChIKey=AJDONJVWDSZZQF-UHFFFAOYSA-N
InChI=1S/C28H42O/c1-25(2,3)19-27(7,8)21-11-15-23(16-12-21)29-24-17-13-22(14-18-24)28(9,10)20-26(4,5)6/h11-18H,19-20H2,1-10H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Bis(4-(1,1,3,3-tetramethylbutyl)phenyl)ether
Systematic Name English
1-(2,4,4-Trimethylpentan-2-yl)-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]benzene
Preferred Name English
Benzene,1,1?-oxybis[4-(1,1,3,3-tetramethylbutyl)-
Systematic Name English
2,2,4-Trimethyl-4-[4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]pentane
Systematic Name English
Code System Code Type Description
CAS
101-58-6
Created by admin on Wed Apr 02 20:30:33 GMT 2025 , Edited by admin on Wed Apr 02 20:30:33 GMT 2025
PRIMARY
FDA UNII
3JB7RM7R5K
Created by admin on Wed Apr 02 20:30:33 GMT 2025 , Edited by admin on Wed Apr 02 20:30:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID80905882
Created by admin on Wed Apr 02 20:30:33 GMT 2025 , Edited by admin on Wed Apr 02 20:30:33 GMT 2025
PRIMARY
PUBCHEM
66867
Created by admin on Wed Apr 02 20:30:33 GMT 2025 , Edited by admin on Wed Apr 02 20:30:33 GMT 2025
PRIMARY