[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite

C22H38F8O17 — CID 153290222

IUPAC[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite
SMILESFCOCC(COCF)OCC(COC(COCF)COCF)OC(COC(COOF)COOF)COC(COOF)COOF
InChIInChI=1S/C22H38F8O17/c23-13-31-1-17(2-32-14-24)35-5-21(6-36-18(3-33-15-25)4-34-16-26)43-22(7-37-19(9-39-44-27)10-40-45-28)8-38-20(11-41-46-29)12-42-47-30/h17-22H,1-16H2
InChIKeyOCTTZMHNSNGXPS-UHFFFAOYSA-N
MW726.51 g/mol
LogP2.39
Rot. Bonds38

About [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite

[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite (PubChem CID 153290222) has the molecular formula C22H38F8O17 and a molecular weight of 726.51 g/mol. Its IUPAC name is [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite.

Molecular Properties

Compound Name[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite
PubChem CID153290222
Molecular FormulaC22H38F8O17
Molecular Weight726.51 g/mol
Exact Mass726.20
IUPAC Name[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite
SMILESFCOCC(COCF)OCC(COC(COCF)COCF)OC(COC(COOF)COOF)COC(COOF)COOF
InChIInChI=1S/C22H38F8O17/c23-13-31-1-17(2-32-14-24)35-5-21(6-36-18(3-33-15-25)4-34-16-26)43-22(7-37-19(9-39-44-27)10-40-45-28)8-38-20(11-41-46-29)12-42-47-30/h17-22H,1-16H2
InChIKeyOCTTZMHNSNGXPS-UHFFFAOYSA-N
XLogP2.39
TPSA156.91 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds38
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.51
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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-[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
[2-[3,4-Bis[1,3-bis(fluoromethoxy)propan-2-yloxy]-1-[1-(2-fluorooxyethoxy)-3-fluoroperoxypropan-2-yl]oxybutan-2-yl]oxy-3-(2-fluorooxyethoxy)propoxy] hypofluorite
CID 153290145
[1-[2,2-Bis[2,3-bis(fluoromethoxy)propoxymethyl]-3-[2,3-bis(fluoroperoxy)propoxy]propoxy]-3-fluoroperoxypropan-2-yl]oxy hypofluorite
CID 153290153

Frequently Asked Questions

What is the IUPAC name of [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite?
The IUPAC name of [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite (CID 153290222) is [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite.
What is the SMILES notation for [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite?
The canonical SMILES for [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite is FCOCC(COCF)OCC(COC(COCF)COCF)OC(COC(COOF)COOF)COC(COOF)COOF.
What is the InChIKey of [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite?
The InChIKey is OCTTZMHNSNGXPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38F8O17/c23-13-31-1-17(2-32-14-24)35-5-21(6-36-18(3-33-15-25)4-34-16-26)43-22(7-37-19(9-39-44-27)10-40-45-28)8-38-20(11-41-46-29)12-42-47-30/h17-22H,1-16H2.
What are the key properties of [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite?
[2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite has a molecular weight of 726.51 g/mol, XLogP of 2.39, 38 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[1,3-bis[1,3-bis(fluoromethoxy)propan-2-yloxy]propan-2-yloxy]-3-[1,3-bis(fluoroperoxy)propan-2-yloxy]propoxy]-3-fluoroperoxypropoxy] hypofluorite is sourced from PubChem (CID 153290222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).