1,1-difluoro-2-methylidenecyclopropane

C4H4F2 — CID 12590905

IUPAC1,1-difluoro-2-methylidenecyclopropane
SMILESC=C1CC1(F)F
InChIInChI=1S/C4H4F2/c1-3-2-4(3,5)6/h1-2H2
InChIKeyLXYBTFPYXKJLAS-UHFFFAOYSA-N
MW90.07 g/mol
LogP1.58
Rot. Bonds

About 1,1-difluoro-2-methylidenecyclopropane

1,1-difluoro-2-methylidenecyclopropane (PubChem CID 12590905) has the molecular formula C4H4F2 and a molecular weight of 90.07 g/mol. Its IUPAC name is 1,1-difluoro-2-methylidenecyclopropane.

Molecular Properties

Compound Name1,1-difluoro-2-methylidenecyclopropane
PubChem CID12590905
Molecular FormulaC4H4F2
Molecular Weight90.07 g/mol
Exact Mass90.03
IUPAC Name1,1-difluoro-2-methylidenecyclopropane
SMILESC=C1CC1(F)F
InChIInChI=1S/C4H4F2/c1-3-2-4(3,5)6/h1-2H2
InChIKeyLXYBTFPYXKJLAS-UHFFFAOYSA-N
XLogP1.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.07
LogP ≤ 51.58
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-methylidenecyclopropane?
The IUPAC name of 1,1-difluoro-2-methylidenecyclopropane (CID 12590905) is 1,1-difluoro-2-methylidenecyclopropane.
What is the SMILES notation for 1,1-difluoro-2-methylidenecyclopropane?
The canonical SMILES for 1,1-difluoro-2-methylidenecyclopropane is C=C1CC1(F)F.
What is the InChIKey of 1,1-difluoro-2-methylidenecyclopropane?
The InChIKey is LXYBTFPYXKJLAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F2/c1-3-2-4(3,5)6/h1-2H2.
What are the key properties of 1,1-difluoro-2-methylidenecyclopropane?
1,1-difluoro-2-methylidenecyclopropane has a molecular weight of 90.07 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-methylidenecyclopropane is sourced from PubChem (CID 12590905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).