U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C3F6O.3H2O
Molecular Weight 386.0897
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXAFLUOROACETONE SESQUIHYDRATE

SMILES

O.O.O.FC(F)(F)C(=O)C(F)(F)F.FC(F)(F)C(=O)C(F)(F)F

InChI

InChIKey=VAIZVCMDJPBJCM-UHFFFAOYSA-N
InChI=1S/2C3F6O.3H2O/c2*4-2(5,6)1(10)3(7,8)9;;;/h;;3*1H2

HIDE SMILES / InChI

Approval Year

Name Type Language
HEXAFLUOROACETONE SESQUIHYDRATE
Common Name English
2-PROPANONE, HEXAFLUORO-, SESQUIHYDRATE
Systematic Name English
2-PROPANONE, 1,1,1,3,3,3-HEXAFLUORO-, SESQUIHYDRATE
Systematic Name English
2-PROPANONE, 1,1,1,3,3,3-HEXAFLUORO-, HYDRATE (2:3)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID7025392
Created by admin on Sat Dec 16 08:03:56 UTC 2023 , Edited by admin on Sat Dec 16 08:03:56 UTC 2023
PRIMARY
PUBCHEM
3032602
Created by admin on Sat Dec 16 08:03:56 UTC 2023 , Edited by admin on Sat Dec 16 08:03:56 UTC 2023
PRIMARY
FDA UNII
CU1NOZ8PS6
Created by admin on Sat Dec 16 08:03:56 UTC 2023 , Edited by admin on Sat Dec 16 08:03:56 UTC 2023
PRIMARY
CAS
13098-39-0
Created by admin on Sat Dec 16 08:03:56 UTC 2023 , Edited by admin on Sat Dec 16 08:03:56 UTC 2023
PRIMARY