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Details

Stereochemistry ACHIRAL
Molecular Formula C5H3F3N2O
Molecular Weight 164.0853
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(TRIFLUOROACETYL)IMIDAZOLE

SMILES

FC(F)(F)C(=O)N1C=CN=C1

InChI

InChIKey=SINBGNJPYWNUQI-UHFFFAOYSA-N
InChI=1S/C5H3F3N2O/c6-5(7,8)4(11)10-2-1-9-3-10/h1-3H

HIDE SMILES / InChI

Molecular Formula C5H3F3N2O
Molecular Weight 164.0853
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Gas chromatography-mass spectrometry analysis of trifluoroacetyl derivatives of precursors of nitrogen and sulfur mustards for verification of chemical weapons convention.
2004-12-03
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:52:59 GMT 2025
Edited
by admin
on Mon Mar 31 18:52:59 GMT 2025
Record UNII
8C6041OW3I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(TRIFLUOROACETYL)IMIDAZOLE
Systematic Name English
NSC-151965
Preferred Name English
ETHANONE, 2,2,2-TRIFLUORO-1-(1H-IMIDAZOL-1-YL)-
Systematic Name English
1H-IMIDAZOLE, 1-(TRIFLUOROACETYL)-
Systematic Name English
IMIDAZOLE, 1-(TRIFLUOROACETYL)-
Systematic Name English
N-(TRIFLUOROACETYL)IMIDAZOLE
Systematic Name English
1-(TRIFLUOROACETYL)-1H-IMIDAZOLE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60165669
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY
ECHA (EC/EINECS)
216-282-5
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY
PUBCHEM
73767
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY
NSC
151965
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY
CAS
1546-79-8
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY
FDA UNII
8C6041OW3I
Created by admin on Mon Mar 31 18:52:59 GMT 2025 , Edited by admin on Mon Mar 31 18:52:59 GMT 2025
PRIMARY