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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O2.C2H7NO
Molecular Weight 205.2945
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHANOLAMINE OCTANOATE

SMILES

NCCO.CCCCCCCC(O)=O

InChI

InChIKey=ZGIPIEWHOQEVJN-UHFFFAOYSA-N
InChI=1S/C8H16O2.C2H7NO/c1-2-3-4-5-6-7-8(9)10;3-1-2-4/h2-7H2,1H3,(H,9,10);4H,1-3H2

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 C2H7NO
Molecular Weight 61.0831
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Polymorphism in 'L' shaped lipids: structure of N-, O-diacylethanolamines with mixed acyl chains.
2009 Nov
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:13:30 GMT 2023
Edited
by admin
on Sat Dec 16 08:13:30 GMT 2023
Record UNII
K1HNW24DY2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHANOLAMINE OCTANOATE
Systematic Name English
OCTANOIC ACID MONOETHANOLAMINE SALT
Common Name English
OCTANOIC ACID, COMPD. WITH 2-AMINOETHANOL (1:1)
Common Name English
ETHANOLAMMONIUM OCTANOATE
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
248-838-8
Created by admin on Sat Dec 16 08:13:30 GMT 2023 , Edited by admin on Sat Dec 16 08:13:30 GMT 2023
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PUBCHEM
160158
Created by admin on Sat Dec 16 08:13:30 GMT 2023 , Edited by admin on Sat Dec 16 08:13:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID5029342
Created by admin on Sat Dec 16 08:13:30 GMT 2023 , Edited by admin on Sat Dec 16 08:13:30 GMT 2023
PRIMARY
FDA UNII
K1HNW24DY2
Created by admin on Sat Dec 16 08:13:30 GMT 2023 , Edited by admin on Sat Dec 16 08:13:30 GMT 2023
PRIMARY
CAS
28098-03-5
Created by admin on Sat Dec 16 08:13:30 GMT 2023 , Edited by admin on Sat Dec 16 08:13:30 GMT 2023
PRIMARY