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Details

Stereochemistry ACHIRAL
Molecular Formula C6H7F3O3
Molecular Weight 184.1132
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl (trifluoroacetyl)acetate

SMILES

CCOC(=O)CC(=O)C(F)(F)F

InChI

InChIKey=OCJKUQIPRNZDTK-UHFFFAOYSA-N
InChI=1S/C6H7F3O3/c1-2-12-5(11)3-4(10)6(7,8)9/h2-3H2,1H3

HIDE SMILES / InChI

Molecular Formula C6H7F3O3
Molecular Weight 184.1132
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 11:07:19 GMT 2023
Edited
by admin
on Sat Dec 16 11:07:19 GMT 2023
Record UNII
KM9XB46R5T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl (trifluoroacetyl)acetate
Systematic Name English
AI3-52657
Code English
NSC-42739
Code English
Butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester
Systematic Name English
Acetoacetic acid, 4,4,4-trifluoro-, ethyl ester
Systematic Name English
Ethyl 4,4,4-trifluoroacetoacetate
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
206-750-7
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
CAS
372-31-6
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
PUBCHEM
67793
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID5059905
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
NSC
42739
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
FDA UNII
KM9XB46R5T
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY