2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate

C6H8F2O6 — CID 118860518

IUPAC2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate
SMILESO=C(OCF)OCCOC(=O)OCF
InChIInChI=1S/C6H8F2O6/c7-3-13-5(9)11-1-2-12-6(10)14-4-8/h1-4H2
InChIKeyFYMMOAOYLUONKK-UHFFFAOYSA-N
MW214.12 g/mol
LogP1.15
Rot. Bonds5

About 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate

2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate (PubChem CID 118860518) has the molecular formula C6H8F2O6 and a molecular weight of 214.12 g/mol. Its IUPAC name is 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate.

Molecular Properties

Compound Name2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate
PubChem CID118860518
Molecular FormulaC6H8F2O6
Molecular Weight214.12 g/mol
Exact Mass214.03
IUPAC Name2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate
SMILESO=C(OCF)OCCOC(=O)OCF
InChIInChI=1S/C6H8F2O6/c7-3-13-5(9)11-1-2-12-6(10)14-4-8/h1-4H2
InChIKeyFYMMOAOYLUONKK-UHFFFAOYSA-N
XLogP1.15
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.12
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate?
The IUPAC name of 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate (CID 118860518) is 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate.
What is the SMILES notation for 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate?
The canonical SMILES for 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate is O=C(OCF)OCCOC(=O)OCF.
What is the InChIKey of 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate?
The InChIKey is FYMMOAOYLUONKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O6/c7-3-13-5(9)11-1-2-12-6(10)14-4-8/h1-4H2.
What are the key properties of 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate?
2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate has a molecular weight of 214.12 g/mol, XLogP of 1.15, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethoxycarbonyloxy)ethyl fluoromethyl carbonate is sourced from PubChem (CID 118860518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).