6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine

C7H4Br2ClF2N — CID 130108046

IUPAC6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine
SMILESFC(F)c1nc(Br)cc(CBr)c1Cl
InChIInChI=1S/C7H4Br2ClF2N/c8-2-3-1-4(9)13-6(5(3)10)7(11)12/h1,7H,2H2
InChIKeyNBOPQSGHVFZNPN-UHFFFAOYSA-N
MW335.37 g/mol
LogP4.33
Rot. Bonds2

About 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine

6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine (PubChem CID 130108046) has the molecular formula C7H4Br2ClF2N and a molecular weight of 335.37 g/mol. Its IUPAC name is 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine.

Molecular Properties

Compound Name6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine
PubChem CID130108046
Molecular FormulaC7H4Br2ClF2N
Molecular Weight335.37 g/mol
Exact Mass332.84
IUPAC Name6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine
SMILESFC(F)c1nc(Br)cc(CBr)c1Cl
InChIInChI=1S/C7H4Br2ClF2N/c8-2-3-1-4(9)13-6(5(3)10)7(11)12/h1,7H,2H2
InChIKeyNBOPQSGHVFZNPN-UHFFFAOYSA-N
XLogP4.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

6-bromo-3-chloro-2-(difluoromethyl)-4-iodopyridine
CID 130107866
6-bromo-4-(bromomethyl)-2-(difluoromethyl)-3-(trifluoromethyl)pyridine
CID 130070176
[4-bromo-5-chloro-6-(difluoromethyl)-2-pyridinyl]methanamine
CID 130108006
6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130101605
6-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130107863
3,6-dichloro-4-(chloromethyl)-2-(difluoromethyl)pyridine
CID 130099341
2-bromo-5-(bromomethyl)-6-(difluoromethyl)-3-methylpyridine
CID 118995667
6-bromo-3-(bromomethyl)-2-(difluoromethyl)pyridine-4-carbonitrile
CID 130108796
4-(bromomethyl)-6-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130073150
3-(bromomethyl)-2-chloro-6-(difluoromethyl)-5-iodopyridine
CID 130073132
3-(bromomethyl)-6-chloro-2-(difluoromethyl)pyridine
CID 130095515
2-(bromomethyl)-5-chloro-6-(difluoromethyl)-3-methylpyridine
CID 130074149

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine?
The IUPAC name of 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine (CID 130108046) is 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine.
What is the SMILES notation for 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine?
The canonical SMILES for 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine is FC(F)c1nc(Br)cc(CBr)c1Cl.
What is the InChIKey of 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine?
The InChIKey is NBOPQSGHVFZNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Br2ClF2N/c8-2-3-1-4(9)13-6(5(3)10)7(11)12/h1,7H,2H2.
What are the key properties of 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine?
6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine has a molecular weight of 335.37 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine is sourced from PubChem (CID 130108046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).