1,2-difluoro-4,5-diphenylbenzene

C18H12F2 — CID 12635519

IUPAC1,2-difluoro-4,5-diphenylbenzene
SMILESFc1cc(-c2ccccc2)c(-c2ccccc2)cc1F
InChIInChI=1S/C18H12F2/c19-17-11-15(13-7-3-1-4-8-13)16(12-18(17)20)14-9-5-2-6-10-14/h1-12H
InChIKeyMSBPEBWJEGWHND-UHFFFAOYSA-N
MW266.29 g/mol
LogP5.30
Rot. Bonds2

About 1,2-difluoro-4,5-diphenylbenzene

1,2-difluoro-4,5-diphenylbenzene (PubChem CID 12635519) has the molecular formula C18H12F2 and a molecular weight of 266.29 g/mol. Its IUPAC name is 1,2-difluoro-4,5-diphenylbenzene.

Molecular Properties

Compound Name1,2-difluoro-4,5-diphenylbenzene
PubChem CID12635519
Molecular FormulaC18H12F2
Molecular Weight266.29 g/mol
Exact Mass266.09
IUPAC Name1,2-difluoro-4,5-diphenylbenzene
SMILESFc1cc(-c2ccccc2)c(-c2ccccc2)cc1F
InChIInChI=1S/C18H12F2/c19-17-11-15(13-7-3-1-4-8-13)16(12-18(17)20)14-9-5-2-6-10-14/h1-12H
InChIKeyMSBPEBWJEGWHND-UHFFFAOYSA-N
XLogP5.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.29
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2-difluoro-4,5-diphenylbenzene?
The IUPAC name of 1,2-difluoro-4,5-diphenylbenzene (CID 12635519) is 1,2-difluoro-4,5-diphenylbenzene.
What is the SMILES notation for 1,2-difluoro-4,5-diphenylbenzene?
The canonical SMILES for 1,2-difluoro-4,5-diphenylbenzene is Fc1cc(-c2ccccc2)c(-c2ccccc2)cc1F.
What is the InChIKey of 1,2-difluoro-4,5-diphenylbenzene?
The InChIKey is MSBPEBWJEGWHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2/c19-17-11-15(13-7-3-1-4-8-13)16(12-18(17)20)14-9-5-2-6-10-14/h1-12H.
What are the key properties of 1,2-difluoro-4,5-diphenylbenzene?
1,2-difluoro-4,5-diphenylbenzene has a molecular weight of 266.29 g/mol, XLogP of 5.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-4,5-diphenylbenzene is sourced from PubChem (CID 12635519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).