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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9F3O
Molecular Weight 202.1731
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(α,α,α-Trifluoro-m-tolyl)-2-propanone

SMILES

CC(=O)CC1=CC=CC(=C1)C(F)(F)F

InChI

InChIKey=JPHQCDCEBDRIOL-UHFFFAOYSA-N
InChI=1S/C10H9F3O/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H9F3O
Molecular Weight 202.1731
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 12:08:42 GMT 2023
Edited
by admin
on Sat Dec 16 12:08:42 GMT 2023
Record UNII
UX2CXD4DHD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(α,α,α-Trifluoro-m-tolyl)-2-propanone
Common Name English
m-(Trifluoromethyl)benzyl methyl ketone
Systematic Name English
m-(Trifluoromethyl)phenylacetone
Systematic Name English
1-[3-(Trifluoromethyl)phenyl]-2-propanone
Systematic Name English
2-Propanone, 1-[3-(trifluoromethyl)phenyl]-
Systematic Name English
2-Propanone, 1-(α,α,α-trifluoro-m-tolyl)-
Systematic Name English
1-(3-Trifluoromethylphenyl)-2-propanone
Systematic Name English
1-(ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLYL)ACETONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
244-652-6
Created by admin on Sat Dec 16 12:08:43 GMT 2023 , Edited by admin on Sat Dec 16 12:08:43 GMT 2023
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FDA UNII
UX2CXD4DHD
Created by admin on Sat Dec 16 12:08:43 GMT 2023 , Edited by admin on Sat Dec 16 12:08:43 GMT 2023
PRIMARY
PUBCHEM
89101
Created by admin on Sat Dec 16 12:08:43 GMT 2023 , Edited by admin on Sat Dec 16 12:08:43 GMT 2023
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EPA CompTox
DTXSID50176320
Created by admin on Sat Dec 16 12:08:43 GMT 2023 , Edited by admin on Sat Dec 16 12:08:43 GMT 2023
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CAS
21906-39-8
Created by admin on Sat Dec 16 12:08:43 GMT 2023 , Edited by admin on Sat Dec 16 12:08:43 GMT 2023
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