1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene

C18H12BrF — CID 168811602

IUPAC1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene
SMILESFc1ccccc1-c1ccccc1-c1ccccc1Br
InChIInChI=1S/C18H12BrF/c19-17-11-5-3-9-15(17)13-7-1-2-8-14(13)16-10-4-6-12-18(16)20/h1-12H
InChIKeySPZGRBHQSJPQKC-UHFFFAOYSA-N
MW327.20 g/mol
LogP5.92
Rot. Bonds2

About 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene

1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene (PubChem CID 168811602) has the molecular formula C18H12BrF and a molecular weight of 327.20 g/mol. Its IUPAC name is 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene.

Molecular Properties

Compound Name1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene
PubChem CID168811602
Molecular FormulaC18H12BrF
Molecular Weight327.20 g/mol
Exact Mass326.01
IUPAC Name1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene
SMILESFc1ccccc1-c1ccccc1-c1ccccc1Br
InChIInChI=1S/C18H12BrF/c19-17-11-5-3-9-15(17)13-7-1-2-8-14(13)16-10-4-6-12-18(16)20/h1-12H
InChIKeySPZGRBHQSJPQKC-UHFFFAOYSA-N
XLogP5.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.20
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene?
The IUPAC name of 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene (CID 168811602) is 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene.
What is the SMILES notation for 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene?
The canonical SMILES for 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene is Fc1ccccc1-c1ccccc1-c1ccccc1Br.
What is the InChIKey of 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene?
The InChIKey is SPZGRBHQSJPQKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12BrF/c19-17-11-5-3-9-15(17)13-7-1-2-8-14(13)16-10-4-6-12-18(16)20/h1-12H.
What are the key properties of 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene?
1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene has a molecular weight of 327.20 g/mol, XLogP of 5.92, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene is sourced from PubChem (CID 168811602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).