2-fluoro-1,1-dimethylcyclopropane

C5H9F — CID 12869597

IUPAC2-fluoro-1,1-dimethylcyclopropane
SMILESCC1(C)CC1F
InChIInChI=1S/C5H9F/c1-5(2)3-4(5)6/h4H,3H2,1-2H3
InChIKeyXXVGLXNVQQFQOB-UHFFFAOYSA-N
MW88.12 g/mol
LogP1.75
Rot. Bonds

About 2-fluoro-1,1-dimethylcyclopropane

2-fluoro-1,1-dimethylcyclopropane (PubChem CID 12869597) has the molecular formula C5H9F and a molecular weight of 88.12 g/mol. Its IUPAC name is 2-fluoro-1,1-dimethylcyclopropane.

Molecular Properties

Compound Name2-fluoro-1,1-dimethylcyclopropane
PubChem CID12869597
Molecular FormulaC5H9F
Molecular Weight88.12 g/mol
Exact Mass88.07
IUPAC Name2-fluoro-1,1-dimethylcyclopropane
SMILESCC1(C)CC1F
InChIInChI=1S/C5H9F/c1-5(2)3-4(5)6/h4H,3H2,1-2H3
InChIKeyXXVGLXNVQQFQOB-UHFFFAOYSA-N
XLogP1.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.12
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1,1-dimethylcyclopropane?
The IUPAC name of 2-fluoro-1,1-dimethylcyclopropane (CID 12869597) is 2-fluoro-1,1-dimethylcyclopropane.
What is the SMILES notation for 2-fluoro-1,1-dimethylcyclopropane?
The canonical SMILES for 2-fluoro-1,1-dimethylcyclopropane is CC1(C)CC1F.
What is the InChIKey of 2-fluoro-1,1-dimethylcyclopropane?
The InChIKey is XXVGLXNVQQFQOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F/c1-5(2)3-4(5)6/h4H,3H2,1-2H3.
What are the key properties of 2-fluoro-1,1-dimethylcyclopropane?
2-fluoro-1,1-dimethylcyclopropane has a molecular weight of 88.12 g/mol, XLogP of 1.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1,1-dimethylcyclopropane is sourced from PubChem (CID 12869597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).