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Details

Stereochemistry ACHIRAL
Molecular Formula C4H5F3O
Molecular Weight 126.0771
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1,1-TRIFLUORO-2-BUTANONE

SMILES

CCC(=O)C(F)(F)F

InChI

InChIKey=QBVHMPFSDVNFAY-UHFFFAOYSA-N
InChI=1S/C4H5F3O/c1-2-3(8)4(5,6)7/h2H2,1H3

HIDE SMILES / InChI

Molecular Formula C4H5F3O
Molecular Weight 126.0771
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 19:14:22 GMT 2023
Edited
by admin
on Sat Dec 16 19:14:22 GMT 2023
Record UNII
DU2S3EQD9U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1,1-TRIFLUORO-2-BUTANONE
Systematic Name English
NSC-42602
Code English
ETHYL TRIFLUOROMETHYL KETONE
Common Name English
2-BUTANONE, 1,1,1-TRIFLUORO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10959050
Created by admin on Sat Dec 16 19:14:22 GMT 2023 , Edited by admin on Sat Dec 16 19:14:22 GMT 2023
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NSC
42602
Created by admin on Sat Dec 16 19:14:22 GMT 2023 , Edited by admin on Sat Dec 16 19:14:22 GMT 2023
PRIMARY
FDA UNII
DU2S3EQD9U
Created by admin on Sat Dec 16 19:14:22 GMT 2023 , Edited by admin on Sat Dec 16 19:14:22 GMT 2023
PRIMARY
CAS
381-88-4
Created by admin on Sat Dec 16 19:14:22 GMT 2023 , Edited by admin on Sat Dec 16 19:14:22 GMT 2023
PRIMARY
PUBCHEM
238288
Created by admin on Sat Dec 16 19:14:23 GMT 2023 , Edited by admin on Sat Dec 16 19:14:23 GMT 2023
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