3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine

C12H7ClF3NO — CID 134626259

IUPAC3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine
SMILESFC(F)(F)Oc1ccccc1-c1cncc(Cl)c1
InChIInChI=1S/C12H7ClF3NO/c13-9-5-8(6-17-7-9)10-3-1-2-4-11(10)18-12(14,15)16/h1-7H
InChIKeyBEVCDLHPIWJQIO-UHFFFAOYSA-N
MW273.64 g/mol
LogP4.30
Rot. Bonds2

About 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine

3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine (PubChem CID 134626259) has the molecular formula C12H7ClF3NO and a molecular weight of 273.64 g/mol. Its IUPAC name is 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine.

Molecular Properties

Compound Name3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine
PubChem CID134626259
Molecular FormulaC12H7ClF3NO
Molecular Weight273.64 g/mol
Exact Mass273.02
IUPAC Name3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine
SMILESFC(F)(F)Oc1ccccc1-c1cncc(Cl)c1
InChIInChI=1S/C12H7ClF3NO/c13-9-5-8(6-17-7-9)10-3-1-2-4-11(10)18-12(14,15)16/h1-7H
InChIKeyBEVCDLHPIWJQIO-UHFFFAOYSA-N
XLogP4.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.64
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N,N-dimethyl-5-[2-(trifluoromethoxy)phenyl]aniline
CID 118846901
3-chloro-2-methoxy-5-[2-(trifluoromethoxy)phenyl]pyridine
CID 134625989
3-chloro-5-[2-(trifluoromethoxy)phenyl]benzonitrile
CID 134629802
5-[2-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)pyridin-2-amine
CID 119015031
3,4,5-tris[2-(trifluoromethoxy)phenyl]pyridine
CID 134622953
1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]benzene
CID 18785200
1-chloro-2-methyl-4-[2-(trifluoromethoxy)phenyl]benzene
CID 134627988
[3,5-bis[2-(trifluoromethoxy)phenyl]-2-pyridinyl]methanol
CID 134623328
4-methoxy-3,5-bis[2-(trifluoromethoxy)phenyl]pyridine
CID 134623318
3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine-4-carbaldehyde
CID 134626254
1-(trifluoromethoxy)-2-[4-(trifluoromethoxy)phenyl]benzene
CID 90959680
5-chloro-3-nitro-2-[2-(trifluoromethoxy)phenyl]pyridine
CID 134629833

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine?
The IUPAC name of 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine (CID 134626259) is 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine.
What is the SMILES notation for 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine?
The canonical SMILES for 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine is FC(F)(F)Oc1ccccc1-c1cncc(Cl)c1.
What is the InChIKey of 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine?
The InChIKey is BEVCDLHPIWJQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClF3NO/c13-9-5-8(6-17-7-9)10-3-1-2-4-11(10)18-12(14,15)16/h1-7H.
What are the key properties of 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine?
3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine has a molecular weight of 273.64 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-[2-(trifluoromethoxy)phenyl]pyridine is sourced from PubChem (CID 134626259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).