1-bromo-3-chloro-5-fluorobenzene

C6H3BrClF — CID 2736223

IUPAC1-bromo-3-chloro-5-fluorobenzene
SMILESFc1cc(Cl)cc(Br)c1
InChIInChI=1S/C6H3BrClF/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKeyGGMDFPMASIXEIR-UHFFFAOYSA-N
MW209.44 g/mol
LogP3.24
Rot. Bonds

About 1-bromo-3-chloro-5-fluorobenzene

1-bromo-3-chloro-5-fluorobenzene (PubChem CID 2736223) has the molecular formula C6H3BrClF and a molecular weight of 209.44 g/mol. Its IUPAC name is 1-bromo-3-chloro-5-fluorobenzene.

Molecular Properties

Compound Name1-bromo-3-chloro-5-fluorobenzene
PubChem CID2736223
Molecular FormulaC6H3BrClF
Molecular Weight209.44 g/mol
Exact Mass207.91
IUPAC Name1-bromo-3-chloro-5-fluorobenzene
SMILESFc1cc(Cl)cc(Br)c1
InChIInChI=1S/C6H3BrClF/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKeyGGMDFPMASIXEIR-UHFFFAOYSA-N
XLogP3.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.44
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

p-Bromochlorobenzene
CID 7806
1-Bromo-3-chlorobenzene
CID 7928
1-Bromo-2-chlorobenzene
CID 12754
Benzene, 1-bromo-3,5-dichloro-
CID 29766
1-Bromo-4-chloro-2-fluorobenzene
CID 137275
2-Bromo-1,4-dichlorobenzene
CID 15033
2-Bromo-4-chloro-1-fluorobenzene
CID 2773264
5-Bromo-1,3-dichloro-2-iodobenzene
CID 4574491
1,3-Dibromo-5-chlorobenzene
CID 84676
1-Bromo-3-chloro-5-iodobenzene
CID 554123
1,4-Dibromo-2-chlorobenzene
CID 2724603
1,3-Dibromo-2-chloro-5-fluorobenzene
CID 2724604

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-chloro-5-fluorobenzene?
The IUPAC name of 1-bromo-3-chloro-5-fluorobenzene (CID 2736223) is 1-bromo-3-chloro-5-fluorobenzene.
What is the SMILES notation for 1-bromo-3-chloro-5-fluorobenzene?
The canonical SMILES for 1-bromo-3-chloro-5-fluorobenzene is Fc1cc(Cl)cc(Br)c1.
What is the InChIKey of 1-bromo-3-chloro-5-fluorobenzene?
The InChIKey is GGMDFPMASIXEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrClF/c7-4-1-5(8)3-6(9)2-4/h1-3H.
What are the key properties of 1-bromo-3-chloro-5-fluorobenzene?
1-bromo-3-chloro-5-fluorobenzene has a molecular weight of 209.44 g/mol, XLogP of 3.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-chloro-5-fluorobenzene is sourced from PubChem (CID 2736223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).