4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one

C6H7FO4 — CID 138667811

IUPAC4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one
SMILESC=C(F)COC1COC(=O)O1
InChIInChI=1S/C6H7FO4/c1-4(7)2-9-5-3-10-6(8)11-5/h5H,1-3H2
InChIKeyOJDKEORJYFTVIZ-UHFFFAOYSA-N
MW162.12 g/mol
LogP0.98
Rot. Bonds3

About 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one

4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one (PubChem CID 138667811) has the molecular formula C6H7FO4 and a molecular weight of 162.12 g/mol. Its IUPAC name is 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one.

Molecular Properties

Compound Name4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one
PubChem CID138667811
Molecular FormulaC6H7FO4
Molecular Weight162.12 g/mol
Exact Mass162.03
IUPAC Name4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one
SMILESC=C(F)COC1COC(=O)O1
InChIInChI=1S/C6H7FO4/c1-4(7)2-9-5-3-10-6(8)11-5/h5H,1-3H2
InChIKeyOJDKEORJYFTVIZ-UHFFFAOYSA-N
XLogP0.98
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.12
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one?
The IUPAC name of 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one (CID 138667811) is 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one.
What is the SMILES notation for 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one?
The canonical SMILES for 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one is C=C(F)COC1COC(=O)O1.
What is the InChIKey of 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one?
The InChIKey is OJDKEORJYFTVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FO4/c1-4(7)2-9-5-3-10-6(8)11-5/h5H,1-3H2.
What are the key properties of 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one?
4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one has a molecular weight of 162.12 g/mol, XLogP of 0.98, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroprop-2-enoxy)-1,3-dioxolan-2-one is sourced from PubChem (CID 138667811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).