1,1-difluoro-2-prop-2-enylcyclopropane

C6H8F2 — CID 58807931

IUPAC1,1-difluoro-2-prop-2-enylcyclopropane
SMILESC=CCC1CC1(F)F
InChIInChI=1S/C6H8F2/c1-2-3-5-4-6(5,7)8/h2,5H,1,3-4H2
InChIKeyYSDVXQZHFFFDHB-UHFFFAOYSA-N
MW118.13 g/mol
LogP2.22
Rot. Bonds2

About 1,1-difluoro-2-prop-2-enylcyclopropane

1,1-difluoro-2-prop-2-enylcyclopropane (PubChem CID 58807931) has the molecular formula C6H8F2 and a molecular weight of 118.13 g/mol. Its IUPAC name is 1,1-difluoro-2-prop-2-enylcyclopropane.

Molecular Properties

Compound Name1,1-difluoro-2-prop-2-enylcyclopropane
PubChem CID58807931
Molecular FormulaC6H8F2
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name1,1-difluoro-2-prop-2-enylcyclopropane
SMILESC=CCC1CC1(F)F
InChIInChI=1S/C6H8F2/c1-2-3-5-4-6(5,7)8/h2,5H,1,3-4H2
InChIKeyYSDVXQZHFFFDHB-UHFFFAOYSA-N
XLogP2.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-prop-2-enylcyclopropane?
The IUPAC name of 1,1-difluoro-2-prop-2-enylcyclopropane (CID 58807931) is 1,1-difluoro-2-prop-2-enylcyclopropane.
What is the SMILES notation for 1,1-difluoro-2-prop-2-enylcyclopropane?
The canonical SMILES for 1,1-difluoro-2-prop-2-enylcyclopropane is C=CCC1CC1(F)F.
What is the InChIKey of 1,1-difluoro-2-prop-2-enylcyclopropane?
The InChIKey is YSDVXQZHFFFDHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2/c1-2-3-5-4-6(5,7)8/h2,5H,1,3-4H2.
What are the key properties of 1,1-difluoro-2-prop-2-enylcyclopropane?
1,1-difluoro-2-prop-2-enylcyclopropane has a molecular weight of 118.13 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-prop-2-enylcyclopropane is sourced from PubChem (CID 58807931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).