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Details

Stereochemistry ACHIRAL
Molecular Formula C15H27F3OS
Molecular Weight 312.434
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(DODECYLTHIO)-1,1,1-TRIFLUORO-2-PROPANONE

SMILES

CCCCCCCCCCCCSCC(=O)C(F)(F)F

InChI

InChIKey=NACMLRDTSWENRZ-UHFFFAOYSA-N
InChI=1S/C15H27F3OS/c1-2-3-4-5-6-7-8-9-10-11-12-20-13-14(19)15(16,17)18/h2-13H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H27F3OS
Molecular Weight 312.434
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 16:26:51 GMT 2023
Edited
by admin
on Sat Dec 16 16:26:51 GMT 2023
Record UNII
C1X75YMY59
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(DODECYLTHIO)-1,1,1-TRIFLUORO-2-PROPANONE
Systematic Name English
2-PROPANONE, 3-(DODECYLTHIO)-1,1,1-TRIFLUORO-
Systematic Name English
3-DODECYLSULFANYL-1,1,1-TRIS(FLUORANYL)PROPAN-2-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
C1X75YMY59
Created by admin on Sat Dec 16 16:26:51 GMT 2023 , Edited by admin on Sat Dec 16 16:26:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID90467547
Created by admin on Sat Dec 16 16:26:51 GMT 2023 , Edited by admin on Sat Dec 16 16:26:51 GMT 2023
PRIMARY
PUBCHEM
11493344
Created by admin on Sat Dec 16 16:26:51 GMT 2023 , Edited by admin on Sat Dec 16 16:26:51 GMT 2023
PRIMARY
CAS
92682-28-5
Created by admin on Sat Dec 16 16:26:51 GMT 2023 , Edited by admin on Sat Dec 16 16:26:51 GMT 2023
PRIMARY