1,1-difluoro-2-methylidenecyclopentane

C6H8F2 — CID 141354520

IUPAC1,1-difluoro-2-methylidenecyclopentane
SMILESC=C1CCCC1(F)F
InChIInChI=1S/C6H8F2/c1-5-3-2-4-6(5,7)8/h1-4H2
InChIKeyYJZJNRQBIYTVHV-UHFFFAOYSA-N
MW118.13 g/mol
LogP2.36
Rot. Bonds

About 1,1-difluoro-2-methylidenecyclopentane

1,1-difluoro-2-methylidenecyclopentane (PubChem CID 141354520) has the molecular formula C6H8F2 and a molecular weight of 118.13 g/mol. Its IUPAC name is 1,1-difluoro-2-methylidenecyclopentane.

Molecular Properties

Compound Name1,1-difluoro-2-methylidenecyclopentane
PubChem CID141354520
Molecular FormulaC6H8F2
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name1,1-difluoro-2-methylidenecyclopentane
SMILESC=C1CCCC1(F)F
InChIInChI=1S/C6H8F2/c1-5-3-2-4-6(5,7)8/h1-4H2
InChIKeyYJZJNRQBIYTVHV-UHFFFAOYSA-N
XLogP2.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 52.36
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-methylidenecyclopentane?
The IUPAC name of 1,1-difluoro-2-methylidenecyclopentane (CID 141354520) is 1,1-difluoro-2-methylidenecyclopentane.
What is the SMILES notation for 1,1-difluoro-2-methylidenecyclopentane?
The canonical SMILES for 1,1-difluoro-2-methylidenecyclopentane is C=C1CCCC1(F)F.
What is the InChIKey of 1,1-difluoro-2-methylidenecyclopentane?
The InChIKey is YJZJNRQBIYTVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2/c1-5-3-2-4-6(5,7)8/h1-4H2.
What are the key properties of 1,1-difluoro-2-methylidenecyclopentane?
1,1-difluoro-2-methylidenecyclopentane has a molecular weight of 118.13 g/mol, XLogP of 2.36, 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-methylidenecyclopentane is sourced from PubChem (CID 141354520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).