5-chloro-2-(2,2-difluoroethoxy)pyridine

C7H6ClF2NO — CID 82005471

IUPAC5-chloro-2-(2,2-difluoroethoxy)pyridine
SMILESFC(F)COc1ccc(Cl)cn1
InChIInChI=1S/C7H6ClF2NO/c8-5-1-2-7(11-3-5)12-4-6(9)10/h1-3,6H,4H2
InChIKeyIBHCFNRGSWDBBV-UHFFFAOYSA-N
MW193.58 g/mol
LogP2.38
Rot. Bonds3

About 5-chloro-2-(2,2-difluoroethoxy)pyridine

5-chloro-2-(2,2-difluoroethoxy)pyridine (PubChem CID 82005471) has the molecular formula C7H6ClF2NO and a molecular weight of 193.58 g/mol. Its IUPAC name is 5-chloro-2-(2,2-difluoroethoxy)pyridine.

Molecular Properties

Compound Name5-chloro-2-(2,2-difluoroethoxy)pyridine
PubChem CID82005471
Molecular FormulaC7H6ClF2NO
Molecular Weight193.58 g/mol
Exact Mass193.01
IUPAC Name5-chloro-2-(2,2-difluoroethoxy)pyridine
SMILESFC(F)COc1ccc(Cl)cn1
InChIInChI=1S/C7H6ClF2NO/c8-5-1-2-7(11-3-5)12-4-6(9)10/h1-3,6H,4H2
InChIKeyIBHCFNRGSWDBBV-UHFFFAOYSA-N
XLogP2.38
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.58
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2,2-difluoroethoxy)pyridine?
The IUPAC name of 5-chloro-2-(2,2-difluoroethoxy)pyridine (CID 82005471) is 5-chloro-2-(2,2-difluoroethoxy)pyridine.
What is the SMILES notation for 5-chloro-2-(2,2-difluoroethoxy)pyridine?
The canonical SMILES for 5-chloro-2-(2,2-difluoroethoxy)pyridine is FC(F)COc1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-2-(2,2-difluoroethoxy)pyridine?
The InChIKey is IBHCFNRGSWDBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClF2NO/c8-5-1-2-7(11-3-5)12-4-6(9)10/h1-3,6H,4H2.
What are the key properties of 5-chloro-2-(2,2-difluoroethoxy)pyridine?
5-chloro-2-(2,2-difluoroethoxy)pyridine has a molecular weight of 193.58 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2,2-difluoroethoxy)pyridine is sourced from PubChem (CID 82005471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).