2-chloro-1-fluoro-3,5-diphenylbenzene

C18H12ClF — CID 23135570

IUPAC2-chloro-1-fluoro-3,5-diphenylbenzene
SMILESFc1cc(-c2ccccc2)cc(-c2ccccc2)c1Cl
InChIInChI=1S/C18H12ClF/c19-18-16(14-9-5-2-6-10-14)11-15(12-17(18)20)13-7-3-1-4-8-13/h1-12H
InChIKeyGREABHLUCSZQMP-UHFFFAOYSA-N
MW282.75 g/mol
LogP5.81
Rot. Bonds2

About 2-chloro-1-fluoro-3,5-diphenylbenzene

2-chloro-1-fluoro-3,5-diphenylbenzene (PubChem CID 23135570) has the molecular formula C18H12ClF and a molecular weight of 282.75 g/mol. Its IUPAC name is 2-chloro-1-fluoro-3,5-diphenylbenzene.

Molecular Properties

Compound Name2-chloro-1-fluoro-3,5-diphenylbenzene
PubChem CID23135570
Molecular FormulaC18H12ClF
Molecular Weight282.75 g/mol
Exact Mass282.06
IUPAC Name2-chloro-1-fluoro-3,5-diphenylbenzene
SMILESFc1cc(-c2ccccc2)cc(-c2ccccc2)c1Cl
InChIInChI=1S/C18H12ClF/c19-18-16(14-9-5-2-6-10-14)11-15(12-17(18)20)13-7-3-1-4-8-13/h1-12H
InChIKeyGREABHLUCSZQMP-UHFFFAOYSA-N
XLogP5.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.75
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-fluoro-3,5-diphenylbenzene?
The IUPAC name of 2-chloro-1-fluoro-3,5-diphenylbenzene (CID 23135570) is 2-chloro-1-fluoro-3,5-diphenylbenzene.
What is the SMILES notation for 2-chloro-1-fluoro-3,5-diphenylbenzene?
The canonical SMILES for 2-chloro-1-fluoro-3,5-diphenylbenzene is Fc1cc(-c2ccccc2)cc(-c2ccccc2)c1Cl.
What is the InChIKey of 2-chloro-1-fluoro-3,5-diphenylbenzene?
The InChIKey is GREABHLUCSZQMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClF/c19-18-16(14-9-5-2-6-10-14)11-15(12-17(18)20)13-7-3-1-4-8-13/h1-12H.
What are the key properties of 2-chloro-1-fluoro-3,5-diphenylbenzene?
2-chloro-1-fluoro-3,5-diphenylbenzene has a molecular weight of 282.75 g/mol, XLogP of 5.81, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-fluoro-3,5-diphenylbenzene is sourced from PubChem (CID 23135570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).