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Details

Stereochemistry ACHIRAL
Molecular Formula C9H4F6O2
Molecular Weight 258.1173
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,4,4-Trifluoro-1-(2-furyl)-3-(trifluoromethyl)-2-buten-1-one

SMILES

FC(F)(F)C(=CC(=O)C1=CC=CO1)C(F)(F)F

InChI

InChIKey=DTQHSVUPGPFERQ-UHFFFAOYSA-N
InChI=1S/C9H4F6O2/c10-8(11,12)7(9(13,14)15)4-5(16)6-2-1-3-17-6/h1-4H

HIDE SMILES / InChI

Molecular Formula C9H4F6O2
Molecular Weight 258.1173
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 Tue Apr 01 19:49:21 GMT 2025
Edited
by admin
on Tue Apr 01 19:49:21 GMT 2025
Record UNII
8KN358J5WF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,4,4-Trifluoro-1-(2-furyl)-3-(trifluoromethyl)-2-buten-1-one
Systematic Name English
NSC-162096
Preferred Name English
4,4,4-Trifluoro-1-(2-furanyl)-3-(trifluoromethyl)-2-buten-1-one
Systematic Name English
2-Buten-1-one, 4,4,4-trifluoro-1-(2-furanyl)-3-(trifluoromethyl)-
Systematic Name English
2-Buten-1-one, 1-(2-furyl)-4,4,4-trifluoro-3-trifluoromethyl-
Systematic Name English
Code System Code Type Description
NSC
162096
Created by admin on Tue Apr 01 19:49:21 GMT 2025 , Edited by admin on Tue Apr 01 19:49:21 GMT 2025
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FDA UNII
8KN358J5WF
Created by admin on Tue Apr 01 19:49:21 GMT 2025 , Edited by admin on Tue Apr 01 19:49:21 GMT 2025
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CAS
35444-09-8
Created by admin on Tue Apr 01 19:49:21 GMT 2025 , Edited by admin on Tue Apr 01 19:49:21 GMT 2025
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PUBCHEM
37145
Created by admin on Tue Apr 01 19:49:21 GMT 2025 , Edited by admin on Tue Apr 01 19:49:21 GMT 2025
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EPA CompTox
DTXSID50188943
Created by admin on Tue Apr 01 19:49:21 GMT 2025 , Edited by admin on Tue Apr 01 19:49:21 GMT 2025
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