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Details

Stereochemistry ACHIRAL
Molecular Formula C12H23N.C8H16O2
Molecular Weight 325.5292
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICYCLOHEXYLAMINE OCTANOATE

SMILES

CCCCCCCC(O)=O.C1CCC(CC1)NC2CCCCC2

InChI

InChIKey=HFNYKMJSBDPKSF-UHFFFAOYSA-N
InChI=1S/C12H23N.C8H16O2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-3-4-5-6-7-8(9)10/h11-13H,1-10H2;2-7H2,1H3,(H,9,10)

HIDE SMILES / InChI
Molecular Formula C8H16O2
Molecular Weight 144.2114
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C12H23N
Molecular Weight 181.3177
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:48:17 UTC 2023
Edited
by admin
on Fri Dec 15 19:48:17 UTC 2023
Record UNII
2OCU38X3W3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICYCLOHEXYLAMINE OCTANOATE
Systematic Name English
OCTANOIC ACID DICYCLOHEXYLAMINE SALT
Systematic Name English
DICYCLOHEXYLAMMONIUM CAPRYLIC ACID SALT
Systematic Name English
DICYCLOHEXYLAMINE CAPRYLATE
Systematic Name English
DICYCLOHEXYLAMMONIUM CAPRYLATE
Systematic Name English
OCTANOIC ACID, COMPD. WITH DICYCLOHEXYLAMINE (1:1)
Systematic Name English
OCTANOIC ACID, COMPD. WITH N-CYCLOHEXYLCYCLOHEXANAMINE (1:1)
Systematic Name English
Code System Code Type Description
CAS
15816-71-4
Created by admin on Fri Dec 15 19:48:17 UTC 2023 , Edited by admin on Fri Dec 15 19:48:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID20935865
Created by admin on Fri Dec 15 19:48:17 UTC 2023 , Edited by admin on Fri Dec 15 19:48:17 UTC 2023
PRIMARY
ECHA (EC/EINECS)
239-914-1
Created by admin on Fri Dec 15 19:48:17 UTC 2023 , Edited by admin on Fri Dec 15 19:48:17 UTC 2023
PRIMARY
PUBCHEM
18398283
Created by admin on Fri Dec 15 19:48:17 UTC 2023 , Edited by admin on Fri Dec 15 19:48:17 UTC 2023
PRIMARY
FDA UNII
2OCU38X3W3
Created by admin on Fri Dec 15 19:48:17 UTC 2023 , Edited by admin on Fri Dec 15 19:48:17 UTC 2023
PRIMARY
Related Record Type Details
Structure of CAPRYLIC ACID
PARENT -> SALT/SOLVATE
NIH
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