1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene

C18H8Br2Cl2F2 — CID 154709388

IUPAC1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene
SMILESFc1cc(Cl)ccc1-c1cc(-c2ccc(Cl)cc2F)c(Br)cc1Br
InChIInChI=1S/C18H8Br2Cl2F2/c19-15-8-16(20)14(12-4-2-10(22)6-18(12)24)7-13(15)11-3-1-9(21)5-17(11)23/h1-8H
InChIKeyWEIDSTGJTRYBSQ-UHFFFAOYSA-N
MW492.97 g/mol
LogP8.13
Rot. Bonds2

About 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene

1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene (PubChem CID 154709388) has the molecular formula C18H8Br2Cl2F2 and a molecular weight of 492.97 g/mol. Its IUPAC name is 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene.

Molecular Properties

Compound Name1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene
PubChem CID154709388
Molecular FormulaC18H8Br2Cl2F2
Molecular Weight492.97 g/mol
Exact Mass489.83
IUPAC Name1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene
SMILESFc1cc(Cl)ccc1-c1cc(-c2ccc(Cl)cc2F)c(Br)cc1Br
InChIInChI=1S/C18H8Br2Cl2F2/c19-15-8-16(20)14(12-4-2-10(22)6-18(12)24)7-13(15)11-3-1-9(21)5-17(11)23/h1-8H
InChIKeyWEIDSTGJTRYBSQ-UHFFFAOYSA-N
XLogP8.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.97
LogP ≤ 58.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-Bromophenyl)-4-chloro-2-fluorobenzene
CID 134938972
4-Bromo-4'-chloro-2-fluoro-1,1'-biphenyl
CID 19042620
1,4-Dibromo-2,5-bis(4-chloro-2-fluorophenyl)benzene
CID 154709389
2,7-Dibromo-3,6-bis(4-chloro-2-fluorophenyl)naphthalene
CID 154709390
1-bromo-4-[(1Z,4E)-1,5-dichloro-1,5-bis(4-fluorophenyl)penta-1,4-dien-3-yl]benzene
CID 134904551
1-chloro-4-[(1E,4E)-1,5-dibromo-5-(4-chlorophenyl)-3-(4-fluorophenyl)penta-1,4-dienyl]benzene
CID 154711493
5-Bromo-2-(4-chlorophenyl)-1,3-difluorobenzene
CID 102440436
4-(4-Bromophenyl)-1-chloro-2-fluorobenzene
CID 2756880
5-(4-Bromophenyl)-2-chloro-1,3-difluorobenzene
CID 19436623
4-[2-(4-Bromophenyl)ethyl]-1-chloro-2-fluorobenzene
CID 19788782
1-Bromo-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-2-(trifluoromethyl)benzene
CID 21987532
4-Bromo-1-(4-chloro-3-fluorophenyl)-2-fluorobenzene
CID 23364839

Frequently Asked Questions

What is the IUPAC name of 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene?
The IUPAC name of 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene (CID 154709388) is 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene.
What is the SMILES notation for 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene?
The canonical SMILES for 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene is Fc1cc(Cl)ccc1-c1cc(-c2ccc(Cl)cc2F)c(Br)cc1Br.
What is the InChIKey of 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene?
The InChIKey is WEIDSTGJTRYBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H8Br2Cl2F2/c19-15-8-16(20)14(12-4-2-10(22)6-18(12)24)7-13(15)11-3-1-9(21)5-17(11)23/h1-8H.
What are the key properties of 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene?
1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene has a molecular weight of 492.97 g/mol, XLogP of 8.13, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dibromo-2,4-bis(4-chloro-2-fluorophenyl)benzene is sourced from PubChem (CID 154709388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).