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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H26O2
Molecular Weight 214.3443
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isotridecanoic acid

SMILES

CC(C)CCCCCCCCCC(O)=O

InChI

InChIKey=SIOLDWZBFABPJU-UHFFFAOYSA-N
InChI=1S/C13H26O2/c1-12(2)10-8-6-4-3-5-7-9-11-13(14)15/h12H,3-11H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Approval Year

Name Type Language
Isotridecanoic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
33002
Created by admin on Sat Dec 16 20:20:21 GMT 2023 , Edited by admin on Sat Dec 16 20:20:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID1067099
Created by admin on Sat Dec 16 20:20:21 GMT 2023 , Edited by admin on Sat Dec 16 20:20:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
246-997-8
Created by admin on Sat Dec 16 20:20:21 GMT 2023 , Edited by admin on Sat Dec 16 20:20:21 GMT 2023
PRIMARY
FDA UNII
5YSZ6ZYK4L
Created by admin on Sat Dec 16 20:20:21 GMT 2023 , Edited by admin on Sat Dec 16 20:20:21 GMT 2023
PRIMARY
CAS
25448-24-2
Created by admin on Sat Dec 16 20:20:21 GMT 2023 , Edited by admin on Sat Dec 16 20:20:21 GMT 2023
PRIMARY