4-(2,2-difluorocyclopropyl)-1,3-dioxolane

C6H8F2O2 — CID 90691833

IUPAC4-(2,2-difluorocyclopropyl)-1,3-dioxolane
SMILESFC1(F)CC1C1COCO1
InChIInChI=1S/C6H8F2O2/c7-6(8)1-4(6)5-2-9-3-10-5/h4-5H,1-3H2
InChIKeyDFEMMEGRLJZIFR-UHFFFAOYSA-N
MW150.12 g/mol
LogP1.01
Rot. Bonds1

About 4-(2,2-difluorocyclopropyl)-1,3-dioxolane

4-(2,2-difluorocyclopropyl)-1,3-dioxolane (PubChem CID 90691833) has the molecular formula C6H8F2O2 and a molecular weight of 150.12 g/mol. Its IUPAC name is 4-(2,2-difluorocyclopropyl)-1,3-dioxolane.

Molecular Properties

Compound Name4-(2,2-difluorocyclopropyl)-1,3-dioxolane
PubChem CID90691833
Molecular FormulaC6H8F2O2
Molecular Weight150.12 g/mol
Exact Mass150.05
IUPAC Name4-(2,2-difluorocyclopropyl)-1,3-dioxolane
SMILESFC1(F)CC1C1COCO1
InChIInChI=1S/C6H8F2O2/c7-6(8)1-4(6)5-2-9-3-10-5/h4-5H,1-3H2
InChIKeyDFEMMEGRLJZIFR-UHFFFAOYSA-N
XLogP1.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.12
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluorocyclopropyl)-1,3-dioxolane?
The IUPAC name of 4-(2,2-difluorocyclopropyl)-1,3-dioxolane (CID 90691833) is 4-(2,2-difluorocyclopropyl)-1,3-dioxolane.
What is the SMILES notation for 4-(2,2-difluorocyclopropyl)-1,3-dioxolane?
The canonical SMILES for 4-(2,2-difluorocyclopropyl)-1,3-dioxolane is FC1(F)CC1C1COCO1.
What is the InChIKey of 4-(2,2-difluorocyclopropyl)-1,3-dioxolane?
The InChIKey is DFEMMEGRLJZIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O2/c7-6(8)1-4(6)5-2-9-3-10-5/h4-5H,1-3H2.
What are the key properties of 4-(2,2-difluorocyclopropyl)-1,3-dioxolane?
4-(2,2-difluorocyclopropyl)-1,3-dioxolane has a molecular weight of 150.12 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluorocyclopropyl)-1,3-dioxolane is sourced from PubChem (CID 90691833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).