1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene

C36H24F2O5 — CID 22338364

IUPAC1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
SMILESFc1ccc(Oc2cccc(Oc3cccc(Oc4cccc(Oc5cccc(Oc6ccc(F)cc6)c5)c4)c3)c2)cc1
InChIInChI=1S/C36H24F2O5/c37-25-13-17-27(18-14-25)39-29-5-1-7-31(21-29)41-33-9-3-11-35(23-33)43-36-12-4-10-34(24-36)42-32-8-2-6-30(22-32)40-28-19-15-26(38)16-20-28/h1-24H
InChIKeyUVOJPCBOIFDXAZ-UHFFFAOYSA-N
MW574.58 g/mol
LogP10.93
Rot. Bonds10

About 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene

1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene (PubChem CID 22338364) has the molecular formula C36H24F2O5 and a molecular weight of 574.58 g/mol. Its IUPAC name is 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene.

Molecular Properties

Compound Name1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
PubChem CID22338364
Molecular FormulaC36H24F2O5
Molecular Weight574.58 g/mol
Exact Mass574.16
IUPAC Name1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
SMILESFc1ccc(Oc2cccc(Oc3cccc(Oc4cccc(Oc5cccc(Oc6ccc(F)cc6)c5)c4)c3)c2)cc1
InChIInChI=1S/C36H24F2O5/c37-25-13-17-27(18-14-25)39-29-5-1-7-31(21-29)41-33-9-3-11-35(23-33)43-36-12-4-10-34(24-36)42-32-8-2-6-30(22-32)40-28-19-15-26(38)16-20-28/h1-24H
InChIKeyUVOJPCBOIFDXAZ-UHFFFAOYSA-N
XLogP10.93
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.58
LogP ≤ 510.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene with MolForge

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Related Compounds

1,4-bis[3-(3-fluorophenoxy)phenoxy]benzene
CID 22338391
1-fluoro-2-[3-[4-[4-[3-(2-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338576
1-fluoro-4-(4-phenoxyphenyl)benzene
CID 163618291
4-[3-(4-fluorophenoxy)phenoxy]-N,N-dimethylbenzenesulfonamide
CID 141362712
2-[3-(4-fluorophenoxy)phenyl]acetaldehyde
CID 170962590
1-fluoro-4-(3-propylphenoxy)benzene
CID 54416846
[3-(4-fluorophenoxy)phenyl]methylidenehydrazine
CID 168530002
2-chloro-4-[3-(4-fluorophenoxy)phenoxy]benzamide
CID 141362722
2-[3-(4-fluorophenoxy)phenyl]-1,3-dioxolane
CID 67442762
1-fluoro-4-[3-(6-phenylhexyl)phenoxy]benzene
CID 58531395
2-[3-(4-fluorophenoxy)phenyl]acetic acid
CID 138754182
1-methoxy-3-[4-[4-(3-methoxyphenoxy)phenoxy]phenoxy]benzene
CID 139804491

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene?
The IUPAC name of 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene (CID 22338364) is 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene.
What is the SMILES notation for 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene?
The canonical SMILES for 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene is Fc1ccc(Oc2cccc(Oc3cccc(Oc4cccc(Oc5cccc(Oc6ccc(F)cc6)c5)c4)c3)c2)cc1.
What is the InChIKey of 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene?
The InChIKey is UVOJPCBOIFDXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24F2O5/c37-25-13-17-27(18-14-25)39-29-5-1-7-31(21-29)41-33-9-3-11-35(23-33)43-36-12-4-10-34(24-36)42-32-8-2-6-30(22-32)40-28-19-15-26(38)16-20-28/h1-24H.
What are the key properties of 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene?
1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene has a molecular weight of 574.58 g/mol, XLogP of 10.93, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene is sourced from PubChem (CID 22338364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).