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Details

Stereochemistry ACHIRAL
Molecular Formula C13H20O2
Molecular Weight 208.2967
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-TERT-BUTYLCUMENEHYDROPEROXIDE

SMILES

CC(C)(C)C1=CC=C(C=C1)C(C)(C)OO

InChI

InChIKey=HSYSVFXBQIIBBJ-UHFFFAOYSA-N
InChI=1S/C13H20O2/c1-12(2,3)10-6-8-11(9-7-10)13(4,5)15-14/h6-9,14H,1-5H3

HIDE SMILES / InChI

Molecular Formula C13H20O2
Molecular Weight 208.2967
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:07:11 GMT 2023
Edited
by admin
on Fri Dec 15 19:07:11 GMT 2023
Record UNII
J8M5GW2MVD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-TERT-BUTYLCUMENEHYDROPEROXIDE
Systematic Name English
HYDROPEROXIDE, 1-(4-(1,1-DIMETHYLETHYL)PHENYL)-1-METHYLETHYL
Systematic Name English
NSC-5558
Code English
1-TERT-BUTYL-4-(2-HYDROPEROXYPROPAN-2-YL)BENZENE
Systematic Name English
1-(4-(1,1-DIMETHYLETHYL)PHENYL)-1-METHYLETHYL HYDROPEROXIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10978569
Created by admin on Fri Dec 15 19:07:11 GMT 2023 , Edited by admin on Fri Dec 15 19:07:11 GMT 2023
PRIMARY
NSC
5558
Created by admin on Fri Dec 15 19:07:11 GMT 2023 , Edited by admin on Fri Dec 15 19:07:11 GMT 2023
PRIMARY
CAS
6285-32-1
Created by admin on Fri Dec 15 19:07:11 GMT 2023 , Edited by admin on Fri Dec 15 19:07:11 GMT 2023
PRIMARY
FDA UNII
J8M5GW2MVD
Created by admin on Fri Dec 15 19:07:11 GMT 2023 , Edited by admin on Fri Dec 15 19:07:11 GMT 2023
PRIMARY
PUBCHEM
221244
Created by admin on Fri Dec 15 19:07:11 GMT 2023 , Edited by admin on Fri Dec 15 19:07:11 GMT 2023
PRIMARY