tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)

C312H349F11 — CID 160613322

IUPACtris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)
SMILESCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1
InChIInChI=1S/2C30H35F.3C29H33F.3C28H31F.3C27H29F/c2*1-3-4-5-6-23-9-13-24(14-10-23)25-15-17-26(18-16-25)28-19-20-29(30(31)21-28)27-11-7-22(2)8-12-27;3*1-3-4-5-22-8-12-23(13-9-22)24-14-16-25(17-15-24)27-18-19-28(29(30)20-27)26-10-6-21(2)7-11-26;3*1-3-4-21-7-11-22(12-8-21)23-13-15-24(16-14-23)26-17-18-27(28(29)19-26)25-9-5-20(2)6-10-25;3*1-3-20-6-10-21(11-7-20)22-12-14-23(15-13-22)25-16-17-26(27(28)18-25)24-8-4-19(2)5-9-24/h2*7-8,11-12,15-21,23-24H,3-6,9-10,13-14H2,1-2H3;3*6-7,10-11,14-20,22-23H,3-5,8-9,12-13H2,1-2H3;3*5-6,9-10,13-19,21-22H,3-4,7-8,11-12H2,1-2H3;3*4-5,8-9,12-18,20-21H,3,6-7,10-11H2,1-2H3
InChIKeyRFTKORALKNWWDV-UHFFFAOYSA-N
MW4308.20 g/mol
LogP95.52
Rot. Bonds59

About tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)

tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) (PubChem CID 160613322) has the molecular formula C312H349F11 and a molecular weight of 4308.20 g/mol. Its IUPAC name is tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene).

Molecular Properties

Compound Nametris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)
PubChem CID160613322
Molecular FormulaC312H349F11
Molecular Weight4308.20 g/mol
Exact Mass4304.71
IUPAC Nametris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)
SMILESCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1
InChIInChI=1S/2C30H35F.3C29H33F.3C28H31F.3C27H29F/c2*1-3-4-5-6-23-9-13-24(14-10-23)25-15-17-26(18-16-25)28-19-20-29(30(31)21-28)27-11-7-22(2)8-12-27;3*1-3-4-5-22-8-12-23(13-9-22)24-14-16-25(17-15-24)27-18-19-28(29(30)20-27)26-10-6-21(2)7-11-26;3*1-3-4-21-7-11-22(12-8-21)23-13-15-24(16-14-23)26-17-18-27(28(29)19-26)25-9-5-20(2)6-10-25;3*1-3-20-6-10-21(11-7-20)22-12-14-23(15-13-22)25-16-17-26(27(28)18-25)24-8-4-19(2)5-9-24/h2*7-8,11-12,15-21,23-24H,3-6,9-10,13-14H2,1-2H3;3*6-7,10-11,14-20,22-23H,3-5,8-9,12-13H2,1-2H3;3*5-6,9-10,13-19,21-22H,3-4,7-8,11-12H2,1-2H3;3*4-5,8-9,12-18,20-21H,3,6-7,10-11H2,1-2H3
InChIKeyRFTKORALKNWWDV-UHFFFAOYSA-N
XLogP95.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds59
Heavy Atoms323
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004308.20
LogP ≤ 595.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) with MolForge

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Related Compounds

2-fluoro-4-(4-methylphenyl)-1-[4-(4-propylcyclohexyl)phenyl]benzene
CID 121399728
tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane
CID 157086367
2-fluoro-4-(4-pentylcyclohexyl)-1-[4-(4-pentylcyclohexyl)phenyl]benzene
CID 3093740
tris(1-(4-butylcyclohexyl)-4-methylbenzene);tetrakis(1-(4-ethylcyclohexyl)-4-methylbenzene);tetrakis(1-methyl-4-(4-propylcyclohexyl)benzene)
CID 158284409
1-[4-(4-butylcyclohexyl)cyclohexyl]-4-methylbenzene;1-[4-(4-ethylcyclohexyl)cyclohexyl]-4-methylbenzene;methane;1-methyl-4-[4-(4-pentylcyclohexyl)cyclohexyl]benzene;1-methyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 160680603
4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-propylphenyl)benzene;1-(4-ethylphenyl)-2-fluoro-4-[4-(4-pentylcyclohexyl)phenyl]benzene;2-fluoro-4-[4-(4-pentylcyclohexyl)phenyl]-1-(4-propylphenyl)benzene;molecular hydrogen
CID 158616323
2-fluoro-1-(4-penta-1,3-diynylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene
CID 118631812
1-(4-decylcyclohexyl)-4-(4-methylphenyl)benzene
CID 20539068
1,2-difluoro-4-[2-fluoro-4-(4-pentylcyclohexyl)phenyl]benzene
CID 10882919
1-[4-(4-butylcyclohexyl)phenyl]-2,4,5-trifluorobenzene
CID 67805684
1,3-difluoro-5-[2-fluoro-4-[4-(4-propylcyclohexyl)phenyl]phenyl]-2-(trifluoromethyl)benzene
CID 147843126
1-[4-(4-butylcyclohexyl)phenyl]-2,3-difluoro-4-(3,4,5-trifluorophenyl)benzene
CID 118912527

Frequently Asked Questions

What is the IUPAC name of tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)?
The IUPAC name of tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) (CID 160613322) is tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene).
What is the SMILES notation for tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)?
The canonical SMILES for tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) is CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3)cc2)CC1.
What is the InChIKey of tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)?
The InChIKey is RFTKORALKNWWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H35F.3C29H33F.3C28H31F.3C27H29F/c2*1-3-4-5-6-23-9-13-24(14-10-23)25-15-17-26(18-16-25)28-19-20-29(30(31)21-28)27-11-7-22(2)8-12-27;3*1-3-4-5-22-8-12-23(13-9-22)24-14-16-25(17-15-24)27-18-19-28(29(30)20-27)26-10-6-21(2)7-11-26;3*1-3-4-21-7-11-22(12-8-21)23-13-15-24(16-14-23)26-17-18-27(28(29)19-26)25-9-5-20(2)6-10-25;3*1-3-20-6-10-21(11-7-20)22-12-14-23(15-13-22)25-16-17-26(27(28)18-25)24-8-4-19(2)5-9-24/h2*7-8,11-12,15-21,23-24H,3-6,9-10,13-14H2,1-2H3;3*6-7,10-11,14-20,22-23H,3-5,8-9,12-13H2,1-2H3;3*5-6,9-10,13-19,21-22H,3-4,7-8,11-12H2,1-2H3;3*4-5,8-9,12-18,20-21H,3,6-7,10-11H2,1-2H3.
What are the key properties of tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene)?
tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) has a molecular weight of 4308.20 g/mol, XLogP of 95.52, 59 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(4-[4-(4-butylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);tris(4-[4-(4-ethylcyclohexyl)phenyl]-2-fluoro-1-(4-methylphenyl)benzene);bis(2-fluoro-1-(4-methylphenyl)-4-[4-(4-pentylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-(4-methylphenyl)-4-[4-(4-propylcyclohexyl)phenyl]benzene) is sourced from PubChem (CID 160613322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).