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

C34H62F8O21 — CID 153290175

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

2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite (PubChem CID 153290175) has the molecular formula C34H62F8O21 and a molecular weight of 958.83 g/mol. Its IUPAC name is 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite.

Molecular Properties

• Compound Name: 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite
• PubChem CID: 153290175
• Molecular Formula: C34H62F8O21
• Molecular Weight: 958.83 g/mol
• Exact Mass: 958.37
• IUPAC Name: 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite
• SMILES: FOCCOCC(COCC(COCC(COCC(COCCOF)OCCOF)OCC(COCCOF)OCCOF)OCC(COCCOF)OCCOF)OCCOF
• InChI: InChI=1S/C34H62F8O21/c35-56-9-1-43-17-29(50-5-13-60-39)21-47-23-31(54-27-33(52-7-15-62-41)19-45-3-11-58-37)25-49-26-32(55-28-34(53-8-16-63-42)20-46-4-12-59-38)24-48-22-30(51-6-14-61-40)18-44-2-10-57-36/h29-34H,1-28H2
• InChIKey: QANTUCFGDAOZOQ-UHFFFAOYSA-N
• XLogP: 2.62
• TPSA: 193.83 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 54
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	958.83
LogP ≤ 5	2.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite?

The IUPAC name of 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite (CID 153290175) is 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite.

What is the SMILES notation for 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite?

The canonical SMILES for 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite is FOCCOCC(COCC(COCC(COCC(COCCOF)OCCOF)OCC(COCCOF)OCCOF)OCC(COCCOF)OCCOF)OCCOF.

What is the InChIKey of 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite?

The InChIKey is QANTUCFGDAOZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H62F8O21/c35-56-9-1-43-17-29(50-5-13-60-39)21-47-23-31(54-27-33(52-7-15-62-41)19-45-3-11-58-37)25-49-26-32(55-28-34(53-8-16-63-42)20-46-4-12-59-38)24-48-22-30(51-6-14-61-40)18-44-2-10-57-36/h29-34H,1-28H2.

What are the key properties of 2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite?

2-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl 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-[1-[1-[2,3-bis[2,3-bis(2-fluorooxyethoxy)propoxy]propoxy]-3-[2,3-bis(2-fluorooxyethoxy)propoxy]propan-2-yl]oxy-3-(2-fluorooxyethoxy)propan-2-yl]oxyethyl hypofluorite is sourced from PubChem (CID 153290175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).