4-bromo-2-chloro-3-(fluoromethoxy)pyridine

C6H4BrClFNO — CID 144501756

IUPAC4-bromo-2-chloro-3-(fluoromethoxy)pyridine
SMILESFCOc1c(Br)ccnc1Cl
InChIInChI=1S/C6H4BrClFNO/c7-4-1-2-10-6(8)5(4)11-3-9/h1-2H,3H2
InChIKeyVWBBUQFWXMOFFO-UHFFFAOYSA-N
MW240.46 g/mol
LogP2.80
Rot. Bonds2

About 4-bromo-2-chloro-3-(fluoromethoxy)pyridine

4-bromo-2-chloro-3-(fluoromethoxy)pyridine (PubChem CID 144501756) has the molecular formula C6H4BrClFNO and a molecular weight of 240.46 g/mol. Its IUPAC name is 4-bromo-2-chloro-3-(fluoromethoxy)pyridine.

Molecular Properties

Compound Name4-bromo-2-chloro-3-(fluoromethoxy)pyridine
PubChem CID144501756
Molecular FormulaC6H4BrClFNO
Molecular Weight240.46 g/mol
Exact Mass238.91
IUPAC Name4-bromo-2-chloro-3-(fluoromethoxy)pyridine
SMILESFCOc1c(Br)ccnc1Cl
InChIInChI=1S/C6H4BrClFNO/c7-4-1-2-10-6(8)5(4)11-3-9/h1-2H,3H2
InChIKeyVWBBUQFWXMOFFO-UHFFFAOYSA-N
XLogP2.80
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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3,4-dichloro-2-(fluoromethoxy)pyridine
CID 67376362
5-bromo-1-chloro-8-methylisoquinoline
CID 82571489
3-bromo-4-chlorothieno[3,2-c]pyridine
CID 18450773
3-bromo-2-chloropyridine
CID 693324
4-bromo-6-ethoxy-7-fluoroquinoline
CID 114764168
4-bromo-2-chloro-1H-pyrrolo[2,3-b]pyridine
CID 163390122
8-bromo-1-chloro-6-fluoroisoquinoline
CID 154727299
2-chloro-3-fluoro-4-propan-2-yloxypyridine
CID 91620513
2-(4-bromo-3-chloro-2-pyridinyl)acetonitrile
CID 130893900
1-chloro-2,4-difluoro-3-(fluoromethoxy)benzene
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Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-chloro-3-(fluoromethoxy)pyridine?
The IUPAC name of 4-bromo-2-chloro-3-(fluoromethoxy)pyridine (CID 144501756) is 4-bromo-2-chloro-3-(fluoromethoxy)pyridine.
What is the SMILES notation for 4-bromo-2-chloro-3-(fluoromethoxy)pyridine?
The canonical SMILES for 4-bromo-2-chloro-3-(fluoromethoxy)pyridine is FCOc1c(Br)ccnc1Cl.
What is the InChIKey of 4-bromo-2-chloro-3-(fluoromethoxy)pyridine?
The InChIKey is VWBBUQFWXMOFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClFNO/c7-4-1-2-10-6(8)5(4)11-3-9/h1-2H,3H2.
What are the key properties of 4-bromo-2-chloro-3-(fluoromethoxy)pyridine?
4-bromo-2-chloro-3-(fluoromethoxy)pyridine has a molecular weight of 240.46 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-chloro-3-(fluoromethoxy)pyridine is sourced from PubChem (CID 144501756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).