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

Details

Stereochemistry RACEMIC
Molecular Formula C9H16O6
Molecular Weight 220.2197
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isopropyl sec-butyl peroxydicarbonate

SMILES

CCC(C)OC(=O)OOC(=O)OC(C)C

InChI

InChIKey=AKUHVUBQELUSIY-UHFFFAOYSA-N
InChI=1S/C9H16O6/c1-5-7(4)13-9(11)15-14-8(10)12-6(2)3/h6-7H,5H2,1-4H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Isopropyl sec-butyl peroxydicarbonate
Systematic Name English
Butan-2-yl propan-2-yloxycarbonyloxy carbonate
Preferred Name English
Peroxydicarbonic acid, C-(1-methylethyl) C?-(1-methylpropyl) ester
Systematic Name English
Code System Code Type Description
FDA UNII
Q65Q8TWC55
Created by admin on Wed Apr 02 19:28:24 GMT 2025 , Edited by admin on Wed Apr 02 19:28:24 GMT 2025
PRIMARY
CAS
78350-78-4
Created by admin on Wed Apr 02 19:28:24 GMT 2025 , Edited by admin on Wed Apr 02 19:28:24 GMT 2025
PRIMARY
PUBCHEM
174128
Created by admin on Wed Apr 02 19:28:24 GMT 2025 , Edited by admin on Wed Apr 02 19:28:24 GMT 2025
PRIMARY
EPA CompTox
DTXSID10893682
Created by admin on Wed Apr 02 19:28:24 GMT 2025 , Edited by admin on Wed Apr 02 19:28:24 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966