2-chloro-4-fluorocyclopentan-1-ol

C5H8ClFO — CID 174283039

IUPAC2-chloro-4-fluorocyclopentan-1-ol
SMILESOC1CC(F)CC1Cl
InChIInChI=1S/C5H8ClFO/c6-4-1-3(7)2-5(4)8/h3-5,8H,1-2H2
InChIKeyCAIZGAARXLYCNJ-UHFFFAOYSA-N
MW138.57 g/mol
LogP1.09
Rot. Bonds

About 2-chloro-4-fluorocyclopentan-1-ol

2-chloro-4-fluorocyclopentan-1-ol (PubChem CID 174283039) has the molecular formula C5H8ClFO and a molecular weight of 138.57 g/mol. Its IUPAC name is 2-chloro-4-fluorocyclopentan-1-ol.

Molecular Properties

Compound Name2-chloro-4-fluorocyclopentan-1-ol
PubChem CID174283039
Molecular FormulaC5H8ClFO
Molecular Weight138.57 g/mol
Exact Mass138.02
IUPAC Name2-chloro-4-fluorocyclopentan-1-ol
SMILESOC1CC(F)CC1Cl
InChIInChI=1S/C5H8ClFO/c6-4-1-3(7)2-5(4)8/h3-5,8H,1-2H2
InChIKeyCAIZGAARXLYCNJ-UHFFFAOYSA-N
XLogP1.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.57
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 2-chloro-4-fluorocyclopentan-1-ol?
The IUPAC name of 2-chloro-4-fluorocyclopentan-1-ol (CID 174283039) is 2-chloro-4-fluorocyclopentan-1-ol.
What is the SMILES notation for 2-chloro-4-fluorocyclopentan-1-ol?
The canonical SMILES for 2-chloro-4-fluorocyclopentan-1-ol is OC1CC(F)CC1Cl.
What is the InChIKey of 2-chloro-4-fluorocyclopentan-1-ol?
The InChIKey is CAIZGAARXLYCNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8ClFO/c6-4-1-3(7)2-5(4)8/h3-5,8H,1-2H2.
What are the key properties of 2-chloro-4-fluorocyclopentan-1-ol?
2-chloro-4-fluorocyclopentan-1-ol has a molecular weight of 138.57 g/mol, XLogP of 1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluorocyclopentan-1-ol is sourced from PubChem (CID 174283039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).