1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene

C22H12F42O13S4 — CID 157479016

About 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene

1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene (PubChem CID 157479016) has the molecular formula C22H12F42O13S4 and a molecular weight of 1410.51 g/mol. Its IUPAC name is 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene.

Molecular Properties

• Compound Name: 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene
• PubChem CID: 157479016
• Molecular Formula: C22H12F42O13S4
• Molecular Weight: 1410.51 g/mol
• Exact Mass: 1409.85
• IUPAC Name: 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene
• SMILES: C=C(F)C(F)(F)OC(F)(F)CF.FC(F)=C(F)OC(F)(F)CC(F)(F)F.FCC(F)(F)C(F)(F)C(F)(F)OC(F)=C(F)F.FCC(F)(F)OC(F)=C(F)F.FCC(F)(F)OF.O=S(=O)(F)F.O=S(=O)(F)F.O=S(=O)(F)F.O=S(=O)(F)F
• InChI: InChI=1S/C6H2F10O.C5H2F8O.C5H4F6O.C4H2F6O.C2H2F4O.4F2O2S/c7-1-4(11,12)5(13,14)6(15,16)17-3(10)2(8)9;6-2(7)3(8)14-5(12,13)1-4(9,10)11;1-3(7)5(10,11)12-4(8,9)2-6;5-1-4(9,10)11-3(8)2(6)7;3-1-2(4,5)7-6;4*1-5(2,3)4/h1H2;1H2;1-2H2;1H2;1H2
• InChIKey: BVYAGRJUJAEOIC-UHFFFAOYSA-N
• XLogP: 14.83
• TPSA: 182.71 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 17
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1410.51
LogP ≤ 5	14.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene?

The IUPAC name of 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene (CID 157479016) is 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene.

What is the SMILES notation for 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene?

The canonical SMILES for 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene is C=C(F)C(F)(F)OC(F)(F)CF.FC(F)=C(F)OC(F)(F)CC(F)(F)F.FCC(F)(F)C(F)(F)C(F)(F)OC(F)=C(F)F.FCC(F)(F)OC(F)=C(F)F.FCC(F)(F)OF.O=S(=O)(F)F.O=S(=O)(F)F.O=S(=O)(F)F.O=S(=O)(F)F.

What is the InChIKey of 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene?

The InChIKey is BVYAGRJUJAEOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F10O.C5H2F8O.C5H4F6O.C4H2F6O.C2H2F4O.4F2O2S/c7-1-4(11,12)5(13,14)6(15,16)17-3(10)2(8)9;6-2(7)3(8)14-5(12,13)1-4(9,10)11;1-3(7)5(10,11)12-4(8,9)2-6;5-1-4(9,10)11-3(8)2(6)7;3-1-2(4,5)7-6;4*1-5(2,3)4/h1H2;1H2;1-2H2;1H2;1H2;;;;.

What are the key properties of 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene?

1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene has a molecular weight of 1410.51 g/mol, XLogP of 14.83, 17 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1,2,2,3,3,4-heptafluoro-1-(1,2,2-trifluoroethenoxy)butane;1,1,1,3,3-pentafluoro-3-(1,2,2-trifluoroethenoxy)propane;tetrakis(sulfuryl difluoride);1,1,2-trifluoroethyl hypofluorite;1,1,2-trifluoro-1-(1,2,2-trifluoroethenoxy)ethane;2,3,3-trifluoro-3-(1,1,2-trifluoroethoxy)prop-1-ene is sourced from PubChem (CID 157479016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).