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Details

Stereochemistry ACHIRAL
Molecular Formula C9H20NO2.I
Molecular Weight 301.1651
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diethyl(2-hydroxyethyl)methylammonium iodide acetate

SMILES

[I-].CC[N+](C)(CC)CCOC(C)=O

InChI

InChIKey=DMYPVBJFABVURF-UHFFFAOYSA-M
InChI=1S/C9H20NO2.HI/c1-5-10(4,6-2)7-8-12-9(3)11;/h5-8H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula HI
Molecular Weight 127.9124
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H20NO2
Molecular Weight 174.2606
Charge 1
Count
Stereochemistry RACEMIC
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 12:51:08 GMT 2023
Edited
by admin
on Sat Dec 16 12:51:08 GMT 2023
Record UNII
WZA4GJ2WRX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl(2-hydroxyethyl)methylammonium iodide acetate
Common Name English
NSC-83578
Code English
Ethanaminium, 2-(acetyloxy)-N,N-diethyl-N-methyl-, iodide
Systematic Name English
Ethanaminium, 2-(acetyloxy)-N,N-diethyl-N-methyl-, iodide (1:1)
Systematic Name English
Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, acetate
Systematic Name English
Code System Code Type Description
FDA UNII
WZA4GJ2WRX
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
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NSC
83578
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
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PUBCHEM
3041171
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
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EPA CompTox
DTXSID40968332
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
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CAS
53566-04-4
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
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