4-chloro-3-(difluoromethyl)-5-fluoropyridine

C6H3ClF3N — CID 130095389

IUPAC4-chloro-3-(difluoromethyl)-5-fluoropyridine
SMILESFc1cncc(C(F)F)c1Cl
InChIInChI=1S/C6H3ClF3N/c7-5-3(6(9)10)1-11-2-4(5)8/h1-2,6H
InChIKeyYQBBAKXEFYRZKY-UHFFFAOYSA-N
MW181.54 g/mol
LogP2.81
Rot. Bonds1

About 4-chloro-3-(difluoromethyl)-5-fluoropyridine

4-chloro-3-(difluoromethyl)-5-fluoropyridine (PubChem CID 130095389) has the molecular formula C6H3ClF3N and a molecular weight of 181.54 g/mol. Its IUPAC name is 4-chloro-3-(difluoromethyl)-5-fluoropyridine.

Molecular Properties

Compound Name4-chloro-3-(difluoromethyl)-5-fluoropyridine
PubChem CID130095389
Molecular FormulaC6H3ClF3N
Molecular Weight181.54 g/mol
Exact Mass180.99
IUPAC Name4-chloro-3-(difluoromethyl)-5-fluoropyridine
SMILESFc1cncc(C(F)F)c1Cl
InChIInChI=1S/C6H3ClF3N/c7-5-3(6(9)10)1-11-2-4(5)8/h1-2,6H
InChIKeyYQBBAKXEFYRZKY-UHFFFAOYSA-N
XLogP2.81
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.54
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,4-dichloro-5-(difluoromethyl)-2-fluoropyridine
CID 130099211
3-(difluoromethyl)-5-fluoropyridine-4-sulfonyl chloride
CID 130096577
3-bromo-4-chloro-5-(difluoromethyl)-2-fluoropyridine
CID 130107809
4-(bromomethyl)-3-(difluoromethyl)-5-fluoropyridine
CID 130096329
3-(difluoromethyl)-5-fluoropyridine-4-carboxylic acid
CID 130096484
4-chloro-5-(difluoromethyl)-2-fluoropyridin-3-ol
CID 118839459
3,4-dichloro-5-(difluoromethyl)pyridine-2-carbaldehyde
CID 130099393
3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
CID 130099248
4-(bromomethyl)-3-chloro-5-(difluoromethyl)pyridine
CID 130095511
4-bromo-5-(difluoromethyl)pyridin-3-amine
CID 130094561
4-bromo-5-(difluoromethyl)pyridin-3-ol
CID 118827771
5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 130095790

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(difluoromethyl)-5-fluoropyridine?
The IUPAC name of 4-chloro-3-(difluoromethyl)-5-fluoropyridine (CID 130095389) is 4-chloro-3-(difluoromethyl)-5-fluoropyridine.
What is the SMILES notation for 4-chloro-3-(difluoromethyl)-5-fluoropyridine?
The canonical SMILES for 4-chloro-3-(difluoromethyl)-5-fluoropyridine is Fc1cncc(C(F)F)c1Cl.
What is the InChIKey of 4-chloro-3-(difluoromethyl)-5-fluoropyridine?
The InChIKey is YQBBAKXEFYRZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClF3N/c7-5-3(6(9)10)1-11-2-4(5)8/h1-2,6H.
What are the key properties of 4-chloro-3-(difluoromethyl)-5-fluoropyridine?
4-chloro-3-(difluoromethyl)-5-fluoropyridine has a molecular weight of 181.54 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(difluoromethyl)-5-fluoropyridine is sourced from PubChem (CID 130095389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).