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3-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyloxolane-2,5-dione

HCID 3719554
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Basic information

CAS
338397-83-4
Standard SMILES
O=C1CC(Sc2ncc(C(F)(F)F)cc2Cl)C(=O)O1
InChIKey
JIDNCDBBERYMGD-UHFFFAOYSA-N
Molecular formula
C10H5ClF3NO3S
Average molar mass
311.67 g/mol
Monoisotopic mass
310.9630764

Names & identifiers

Preferred name
3-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyloxolane-2,5-dione
IUPAC
3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]oxolane-2,5-dione
English name
3-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]SULFANYL)DIHYDRO-2,5-FURANDIONE
Molecular formula
C10H5ClF3NO3S
Molecular weight
311.66

Names & synonyms

338397-83-43-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}oxolane-2,5-dione3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyloxolane-2,5-dione3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}dihydro-2,5-furandioneDTXSID701149753AKOS0050848852H-0593-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)thio)dihydrofuran-2,5-dione3-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]thio]dihydro-2,5-furandione2,5-Furandione, 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]dihydro-3-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]SULFANYL)DIHYDRO-2,5-FURANDIONE

Database identifiers

CAS
338397-83-4
PubChem CID
3719554
DTXSID
DTXSID701149753

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
81.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
393

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