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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H31N3O3
Molecular Weight 349.4677
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,6-DIALLYLOXY-2-DECYLOXY-1,3,5-TRIAZINE

SMILES

CCCCCCCCCCOC1=NC(OCC=C)=NC(OCC=C)=N1

InChI

InChIKey=SPKLHDQJUGTSTI-UHFFFAOYSA-N
InChI=1S/C19H31N3O3/c1-4-7-8-9-10-11-12-13-16-25-19-21-17(23-14-5-2)20-18(22-19)24-15-6-3/h5-6H,2-4,7-16H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H31N3O3
Molecular Weight 349.4677
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 Tue Apr 01 18:56:07 GMT 2025
Edited
by admin
on Tue Apr 01 18:56:07 GMT 2025
Record UNII
I9UA76G6NH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3,5-TRIAZINE, 2-(DECYLOXY)-4,6-BIS(2-PROPEN-1-YLOXY)-
Preferred Name English
4,6-DIALLYLOXY-2-DECYLOXY-1,3,5-TRIAZINE
Systematic Name English
2-(DECYLOXY)-4,6-BIS(2-PROPEN-1-YLOXY)-1,3,5-TRIAZINE
Systematic Name English
Code System Code Type Description
FDA UNII
I9UA76G6NH
Created by admin on Tue Apr 01 18:56:07 GMT 2025 , Edited by admin on Tue Apr 01 18:56:07 GMT 2025
PRIMARY
ECHA (EC/EINECS)
288-802-9
Created by admin on Tue Apr 01 18:56:07 GMT 2025 , Edited by admin on Tue Apr 01 18:56:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID00235219
Created by admin on Tue Apr 01 18:56:07 GMT 2025 , Edited by admin on Tue Apr 01 18:56:07 GMT 2025
PRIMARY
CAS
85896-26-0
Created by admin on Tue Apr 01 18:56:07 GMT 2025 , Edited by admin on Tue Apr 01 18:56:07 GMT 2025
PRIMARY
PUBCHEM
16205645
Created by admin on Tue Apr 01 18:56:07 GMT 2025 , Edited by admin on Tue Apr 01 18:56:07 GMT 2025
PRIMARY