1-chloro-1,2,2,3,3-pentafluorocyclopropane

C3ClF5 — CID 23233207

IUPAC1-chloro-1,2,2,3,3-pentafluorocyclopropane
SMILESFC1(F)C(F)(F)C1(F)Cl
InChIInChI=1S/C3ClF5/c4-1(5)2(6,7)3(1,8)9
InChIKeyIECBEYMGECZHJY-UHFFFAOYSA-N
MW166.48 g/mol
LogP2.18
Rot. Bonds

About 1-chloro-1,2,2,3,3-pentafluorocyclopropane

1-chloro-1,2,2,3,3-pentafluorocyclopropane (PubChem CID 23233207) has the molecular formula C3ClF5 and a molecular weight of 166.48 g/mol. Its IUPAC name is 1-chloro-1,2,2,3,3-pentafluorocyclopropane.

Molecular Properties

Compound Name1-chloro-1,2,2,3,3-pentafluorocyclopropane
PubChem CID23233207
Molecular FormulaC3ClF5
Molecular Weight166.48 g/mol
Exact Mass165.96
IUPAC Name1-chloro-1,2,2,3,3-pentafluorocyclopropane
SMILESFC1(F)C(F)(F)C1(F)Cl
InChIInChI=1S/C3ClF5/c4-1(5)2(6,7)3(1,8)9
InChIKeyIECBEYMGECZHJY-UHFFFAOYSA-N
XLogP2.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.48
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-1,2,2,3,3-pentafluorocyclopropane?
The IUPAC name of 1-chloro-1,2,2,3,3-pentafluorocyclopropane (CID 23233207) is 1-chloro-1,2,2,3,3-pentafluorocyclopropane.
What is the SMILES notation for 1-chloro-1,2,2,3,3-pentafluorocyclopropane?
The canonical SMILES for 1-chloro-1,2,2,3,3-pentafluorocyclopropane is FC1(F)C(F)(F)C1(F)Cl.
What is the InChIKey of 1-chloro-1,2,2,3,3-pentafluorocyclopropane?
The InChIKey is IECBEYMGECZHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3ClF5/c4-1(5)2(6,7)3(1,8)9.
What are the key properties of 1-chloro-1,2,2,3,3-pentafluorocyclopropane?
1-chloro-1,2,2,3,3-pentafluorocyclopropane has a molecular weight of 166.48 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-1,2,2,3,3-pentafluorocyclopropane is sourced from PubChem (CID 23233207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).