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Details

Stereochemistry ACHIRAL
Molecular Formula C20H41N.C2H4O2
Molecular Weight 355.5982
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 9-OCTADECEN-1-AMINE, N,N-DIMETHYL-, (Z)-, ACETATE

SMILES

CC(O)=O.CCCCCCCC\C=C/CCCCCCCCN(C)C

InChI

InChIKey=JEHBDHQRPICJAX-AFEZEDKISA-N
InChI=1S/C20H41N.C2H4O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3;1-2(3)4/h11-12H,4-10,13-20H2,1-3H3;1H3,(H,3,4)/b12-11-;

HIDE SMILES / InChI

Molecular Formula C20H41N
Molecular Weight 295.5462
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C2H4O2
Molecular Weight 60.052
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 Sat Dec 16 08:38:30 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:30 GMT 2023
Record UNII
ACF6J9736F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-OCTADECEN-1-AMINE, N,N-DIMETHYL-, (Z)-, ACETATE
Systematic Name English
N,N-DIMETHYLOLEYLAMINE ACETATE
Systematic Name English
Code System Code Type Description
CAS
22968-84-9
Created by admin on Sat Dec 16 08:38:30 GMT 2023 , Edited by admin on Sat Dec 16 08:38:30 GMT 2023
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PUBCHEM
76967353
Created by admin on Sat Dec 16 08:38:30 GMT 2023 , Edited by admin on Sat Dec 16 08:38:30 GMT 2023
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FDA UNII
ACF6J9736F
Created by admin on Sat Dec 16 08:38:30 GMT 2023 , Edited by admin on Sat Dec 16 08:38:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID10895106
Created by admin on Sat Dec 16 08:38:30 GMT 2023 , Edited by admin on Sat Dec 16 08:38:30 GMT 2023
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