1-chloro-2-cyclopropyl-1-fluorocyclopropane

C6H8ClF — CID 134853873

IUPAC1-chloro-2-cyclopropyl-1-fluorocyclopropane
SMILESFC1(Cl)CC1C1CC1
InChIInChI=1S/C6H8ClF/c7-6(8)3-5(6)4-1-2-4/h4-5H,1-3H2
InChIKeyFRACNFKMDOAWOY-UHFFFAOYSA-N
MW134.58 g/mol
LogP2.32
Rot. Bonds1

About 1-chloro-2-cyclopropyl-1-fluorocyclopropane

1-chloro-2-cyclopropyl-1-fluorocyclopropane (PubChem CID 134853873) has the molecular formula C6H8ClF and a molecular weight of 134.58 g/mol. Its IUPAC name is 1-chloro-2-cyclopropyl-1-fluorocyclopropane.

Molecular Properties

Compound Name1-chloro-2-cyclopropyl-1-fluorocyclopropane
PubChem CID134853873
Molecular FormulaC6H8ClF
Molecular Weight134.58 g/mol
Exact Mass134.03
IUPAC Name1-chloro-2-cyclopropyl-1-fluorocyclopropane
SMILESFC1(Cl)CC1C1CC1
InChIInChI=1S/C6H8ClF/c7-6(8)3-5(6)4-1-2-4/h4-5H,1-3H2
InChIKeyFRACNFKMDOAWOY-UHFFFAOYSA-N
XLogP2.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.58
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-cyclopropyl-1-fluorocyclopropane?
The IUPAC name of 1-chloro-2-cyclopropyl-1-fluorocyclopropane (CID 134853873) is 1-chloro-2-cyclopropyl-1-fluorocyclopropane.
What is the SMILES notation for 1-chloro-2-cyclopropyl-1-fluorocyclopropane?
The canonical SMILES for 1-chloro-2-cyclopropyl-1-fluorocyclopropane is FC1(Cl)CC1C1CC1.
What is the InChIKey of 1-chloro-2-cyclopropyl-1-fluorocyclopropane?
The InChIKey is FRACNFKMDOAWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClF/c7-6(8)3-5(6)4-1-2-4/h4-5H,1-3H2.
What are the key properties of 1-chloro-2-cyclopropyl-1-fluorocyclopropane?
1-chloro-2-cyclopropyl-1-fluorocyclopropane has a molecular weight of 134.58 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-cyclopropyl-1-fluorocyclopropane is sourced from PubChem (CID 134853873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).