1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene

C48H32F2 — CID 58320925

IUPAC1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
SMILESFc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(F)cc8)cc7)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C48H32F2/c49-47-29-25-45(26-30-47)43-21-17-41(18-22-43)39-13-9-37(10-14-39)35-5-1-33(2-6-35)34-3-7-36(8-4-34)38-11-15-40(16-12-38)42-19-23-44(24-20-42)46-27-31-48(50)32-28-46/h1-32H
InChIKeyWKNDQJSEVMFUJW-UHFFFAOYSA-N
MW646.78 g/mol
LogP13.63
Rot. Bonds7

About 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene

1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene (PubChem CID 58320925) has the molecular formula C48H32F2 and a molecular weight of 646.78 g/mol. Its IUPAC name is 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
PubChem CID58320925
Molecular FormulaC48H32F2
Molecular Weight646.78 g/mol
Exact Mass646.25
IUPAC Name1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
SMILESFc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(F)cc8)cc7)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C48H32F2/c49-47-29-25-45(26-30-47)43-21-17-41(18-22-43)39-13-9-37(10-14-39)35-5-1-33(2-6-35)34-3-7-36(8-4-34)38-11-15-40(16-12-38)42-19-23-44(24-20-42)46-27-31-48(50)32-28-46/h1-32H
InChIKeyWKNDQJSEVMFUJW-UHFFFAOYSA-N
XLogP13.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500646.78
LogP ≤ 513.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-fluoro-4-(4-fluorophenyl)benzene;formaldehyde
CID 175463820
lithium;1-fluoro-4-phenylbenzene;hydride
CID 173443965
1,4-difluorobenzene bromide
CID 21301175
1,2,3-trifluoro-5-(4-fluorophenyl)benzene
CID 12982677
3-(4-fluorophenyl)-1H-pyrrole
CID 12665440
1-ethyl-4-(4-fluorophenyl)benzene
CID 21432911
2,3,5,6-tetrakis(4-fluorophenyl)pyrazine
CID 132966321
1-fluoro-4-[4-(2-iodoethyl)phenyl]benzene
CID 66577934
1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene
CID 19780903
1-[4-(4-fluorophenyl)phenyl]ethenol
CID 143634078
hexadecacyclo[56.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29.230,33.234,37.238,41.242,45.246,49.250,53.254,57]nonaconta-1(60),2(90),3,5(89),6(88),7,9(87),10(86),11,13(85),14(84),15,17(83),18(82),19,21(81),22(80),23,25(79),26(78),27,29(77),30(76),31,33(75),34,36,38,40,42,44,46,48,50,52,54,56,58,61,63,65,67,69,71,73-pentatetracontaene
CID 123382186
1-fluoro-4-methylbenzene;methane
CID 158431518

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene?
The IUPAC name of 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene (CID 58320925) is 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene.
What is the SMILES notation for 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene?
The canonical SMILES for 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene is Fc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(F)cc8)cc7)cc6)cc5)cc4)cc3)cc2)cc1.
What is the InChIKey of 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene?
The InChIKey is WKNDQJSEVMFUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32F2/c49-47-29-25-45(26-30-47)43-21-17-41(18-22-43)39-13-9-37(10-14-39)35-5-1-33(2-6-35)34-3-7-36(8-4-34)38-11-15-40(16-12-38)42-19-23-44(24-20-42)46-27-31-48(50)32-28-46/h1-32H.
What are the key properties of 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene?
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene has a molecular weight of 646.78 g/mol, XLogP of 13.63, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene is sourced from PubChem (CID 58320925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).