2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite

C34H62F8O21 — CID 153290243

IUPAC2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite
SMILESFOCCOCC(COCCOF)OCC(COCC(COC(COCCOF)COCCOF)OC(COCCOF)COCCOF)OC(COCCOF)COCCOF
InChIInChI=1S/C34H62F8O21/c35-54-9-1-43-17-29(18-44-2-10-55-36)52-27-33(62-31(21-47-5-13-58-39)22-48-6-14-59-40)25-51-26-34(63-32(23-49-7-15-60-41)24-50-8-16-61-42)28-53-30(19-45-3-11-56-37)20-46-4-12-57-38/h29-34H,1-28H2
InChIKeyLZCUWSGYOOQXGT-UHFFFAOYSA-N
MW958.83 g/mol
LogP2.62
Rot. Bonds54

About 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite

2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite (PubChem CID 153290243) has the molecular formula C34H62F8O21 and a molecular weight of 958.83 g/mol. Its IUPAC name is 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite.

Molecular Properties

Compound Name2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite
PubChem CID153290243
Molecular FormulaC34H62F8O21
Molecular Weight958.83 g/mol
Exact Mass958.37
IUPAC Name2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite
SMILESFOCCOCC(COCCOF)OCC(COCC(COC(COCCOF)COCCOF)OC(COCCOF)COCCOF)OC(COCCOF)COCCOF
InChIInChI=1S/C34H62F8O21/c35-54-9-1-43-17-29(18-44-2-10-55-36)52-27-33(62-31(21-47-5-13-58-39)22-48-6-14-59-40)25-51-26-34(63-32(23-49-7-15-60-41)24-50-8-16-61-42)28-53-30(19-45-3-11-56-37)20-46-4-12-57-38/h29-34H,1-28H2
InChIKeyLZCUWSGYOOQXGT-UHFFFAOYSA-N
XLogP2.62
TPSA193.83 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds54
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500958.83
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite with MolForge

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Related Compounds

1,1,2,3,3-Pentafluoro-1,3-bis(fluoromethoxy)-2-[1,1,2,3,3-pentafluoro-3-[1,1,2,3,3-pentafluoro-1-(fluoromethoxy)-3-(1,2,2-trifluoro-2-methoxyethoxy)propan-2-yl]oxy-2-[1,1,2,3,3-pentafluoro-3-[1,1,2,3,3-pentafluoro-1-[1,1,2,3,3-pentafluoro-1,3-bis(fluoromethoxy)propan-2-yl]oxy-3-[1,1,2,3,3-pentafluoro-1-(fluoromethoxy)-3-(1,2,2,2-tetrafluoroethoxy)propan-2-yl]oxypropan-2-yl]oxy-2-[1,1,2,2-tetrafluoro-2-(1,1,1,2-tetrafluoropropan-2-yloxy)ethoxy]propoxy]propoxy]propane
CID 20647694
1-[3-[3-[3-[3-[2,3-Bis(fluoromethoxy)propoxy]-2-ethoxypropoxy]-2-(fluoromethoxy)propoxy]-2-ethoxypropoxy]-2-(fluoromethoxy)propoxy]-2,3-diethoxypropane
CID 59364572
1,1,1,3,3,3-Hexafluoro-2-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-propoxypropoxy]-2-(trifluoromethyl)propane
CID 129013086
[1-[2,2-Bis[2,3-bis(2-fluorooxyethoxy)propoxymethyl]-3-[2,3-bis(fluoroperoxy)propoxy]propoxy]-3-fluoroperoxypropan-2-yl]oxy hypofluorite
CID 135274587
2-[2-[2,2-Bis[1,3-bis(fluoromethoxy)propan-2-yloxymethyl]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite
CID 135274588
[2-[3,4-Bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]-1-[1,3-bis(fluoroperoxy)propan-2-yloxy]butan-2-yl]oxy-3-fluoroperoxypropoxy] hypofluorite
CID 135274589
[1-[3,4-Bis[2,3-bis(2-fluorooxyethoxy)propoxy]-1-[2,3-bis(fluoroperoxy)propoxy]butan-2-yl]oxy-3-fluoroperoxypropan-2-yl]oxy hypofluorite
CID 135274590
2-[2-[2-[1,3-Bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite
CID 135274593
2-[1-[2-[1,3-Bis[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yloxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite
CID 135274594
[2-[1-[2,3-Bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propan-2-yl]oxy-3-fluoroperoxypropoxy] hypofluorite
CID 135274595
[2-[2-[1,3-Bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite
CID 135274633
[1-[1-[2,3-Bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(fluoroperoxy)propoxy]propan-2-yl]oxy-3-fluoroperoxypropan-2-yl]oxy hypofluorite
CID 135274822

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite?
The IUPAC name of 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite (CID 153290243) is 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite.
What is the SMILES notation for 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite?
The canonical SMILES for 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite is FOCCOCC(COCCOF)OCC(COCC(COC(COCCOF)COCCOF)OC(COCCOF)COCCOF)OC(COCCOF)COCCOF.
What is the InChIKey of 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite?
The InChIKey is LZCUWSGYOOQXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H62F8O21/c35-54-9-1-43-17-29(18-44-2-10-55-36)52-27-33(62-31(21-47-5-13-58-39)22-48-6-14-59-40)25-51-26-34(63-32(23-49-7-15-60-41)24-50-8-16-61-42)28-53-30(19-45-3-11-56-37)20-46-4-12-57-38/h29-34H,1-28H2.
What are the key properties of 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite?
2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite has a molecular weight of 958.83 g/mol, XLogP of 2.62, 54 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-[2,3-bis[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propoxy]-3-[1,3-bis(2-fluorooxyethoxy)propan-2-yloxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy]ethyl hypofluorite is sourced from PubChem (CID 153290243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).