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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H27N.C7H6O3
Molecular Weight 323.4702
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DODECYLAMINE SALICYLATE

SMILES

OC(=O)C1=C(O)C=CC=C1.CCCCCCCCCCCCN

InChI

InChIKey=BDBHIKNRLLPPCL-UHFFFAOYSA-N
InChI=1S/C12H27N.C7H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13;8-6-4-2-1-3-5(6)7(9)10/h2-13H2,1H3;1-4,8H,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C12H27N
Molecular Weight 185.3495
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H6O3
Molecular Weight 138.1207
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:36:45 UTC 2023
Edited
by admin
on Fri Dec 15 18:36:45 UTC 2023
Record UNII
098DXT30J6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DODECYLAMINE SALICYLATE
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 39302
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
Code System Code Type Description
FDA UNII
098DXT30J6
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
PRIMARY
CAS
7491-21-6
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
PRIMARY
ECHA (EC/EINECS)
231-311-1
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
PRIMARY
PUBCHEM
24099
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID2075007
Created by admin on Fri Dec 15 18:36:45 UTC 2023 , Edited by admin on Fri Dec 15 18:36:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE