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Octafluoro-p-dithiane

HCID 12829
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Basic information

CAS
710-65-6
Standard SMILES
FC1(F)SC(F)(F)C(F)(F)SC1(F)F
InChIKey
MABSKGZSSMBURB-UHFFFAOYSA-N
Molecular formula
C4F8S2
Average molar mass
264.2 g/mol
Monoisotopic mass
263.93136764

Names & identifiers

Preferred name
Octafluoro-p-dithiane
IUPAC
2,2,3,3,5,5,6,6-octafluoro-1,4-dithiane
English name
Octafluoro-1,4-dithiane
Molecular formula
C4F8S2
Molecular weight
264.16

Names & synonyms

710-65-6Octafluoro-p-dithianeDTXSID70221225RefChem:1093775DTXCID70143716Octafluoro-1,4-dithianep-DITHIANE, OCTAFLUORO-2,2,3,3,5,5,6,6-octafluoro-1,4-dithianeBRN 1344695477RVV2WVS1,4-Dithiane, 2,2,3,3,5,5,6,6-octafluoro-5-19-01-00039 (Beilstein Handbook Reference)
Show more names
SCHEMBL6650422MABSKGZSSMBURB-UHFFFAOYSA-N

Database identifiers

CAS
710-65-6
PubChem CID
12829
DTXSID
DTXSID70221225
UNII
477RVV2WVS
Nikkaji
J42.233I

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
50.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
198

Experimental & physicochemical properties

SpringerMaterials Properties19F nuclear magnetic resonance spectrum

Physicochemical properties

Boiling point
70.33 °C · 70.33°C (estimate)
Density
1.78 · 1.78±0.1 g/cm3(Predicted)

Related reactions

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Compound notes

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