2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene

C128H101F19O2 — CID 54012927

IUPAC2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
SMILESCc1c(-c2ccccc2)cc(-c2cc(-c3ccccc3)c(C)c(-c3ccccc3)c2)cc1-c1ccccc1.Cc1cc(F)c(-c2c(F)cc(C)cc2F)c(F)c1.Cc1ccc(-c2ccc(C)cc2C(F)(F)F)c(C(F)(F)F)c1.Cc1ccc(-c2ccc(C)cc2OC(F)(F)F)c(C)c1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc2c(c1)Oc1cc(C)ccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C38H30.C27H20O.C17H14F6.C16H12F6.C16H15F3O.C14H10F4/c1-27-35(29-15-7-3-8-16-29)23-33(24-36(27)30-17-9-4-10-18-30)34-25-37(31-19-11-5-12-20-31)28(2)38(26-34)32-21-13-6-14-22-32;1-17-11-13-23-25(15-17)28-26-16-18(2)12-14-24(26)27(23)21-9-5-3-7-19(21)20-8-4-6-10-22(20)27;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-9-3-5-11(13(7-9)15(17,18)19)12-6-4-10(2)8-14(12)16(20,21)22;1-10-4-6-13(12(3)8-10)14-7-5-11(2)9-15(14)20-16(17,18)19;1-7-3-9(15)13(10(16)4-7)14-11(17)5-8(2)6-12(14)18/h3-26H,1-2H3;3-16H,1-2H3;3-10H,1-2H3;3-8H,1-2H3;4-9H,1-3H3;3-6H,1-2H3
InChIKeyKTQGQFQNONXOID-UHFFFAOYSA-N
MW2032.18 g/mol
LogP38.84
Rot. Bonds11

About 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene

2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene (PubChem CID 54012927) has the molecular formula C128H101F19O2 and a molecular weight of 2032.18 g/mol. Its IUPAC name is 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene.

Molecular Properties

Compound Name2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
PubChem CID54012927
Molecular FormulaC128H101F19O2
Molecular Weight2032.18 g/mol
Exact Mass2030.75
IUPAC Name2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
SMILESCc1c(-c2ccccc2)cc(-c2cc(-c3ccccc3)c(C)c(-c3ccccc3)c2)cc1-c1ccccc1.Cc1cc(F)c(-c2c(F)cc(C)cc2F)c(F)c1.Cc1ccc(-c2ccc(C)cc2C(F)(F)F)c(C(F)(F)F)c1.Cc1ccc(-c2ccc(C)cc2OC(F)(F)F)c(C)c1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc2c(c1)Oc1cc(C)ccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C38H30.C27H20O.C17H14F6.C16H12F6.C16H15F3O.C14H10F4/c1-27-35(29-15-7-3-8-16-29)23-33(24-36(27)30-17-9-4-10-18-30)34-25-37(31-19-11-5-12-20-31)28(2)38(26-34)32-21-13-6-14-22-32;1-17-11-13-23-25(15-17)28-26-16-18(2)12-14-24(26)27(23)21-9-5-3-7-19(21)20-8-4-6-10-22(20)27;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-9-3-5-11(13(7-9)15(17,18)19)12-6-4-10(2)8-14(12)16(20,21)22;1-10-4-6-13(12(3)8-10)14-7-5-11(2)9-15(14)20-16(17,18)19;1-7-3-9(15)13(10(16)4-7)14-11(17)5-8(2)6-12(14)18/h3-26H,1-2H3;3-16H,1-2H3;3-10H,1-2H3;3-8H,1-2H3;4-9H,1-3H3;3-6H,1-2H3
InChIKeyKTQGQFQNONXOID-UHFFFAOYSA-N
XLogP38.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms149
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002032.18
LogP ≤ 538.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene with MolForge

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Related Compounds

9,9-bis(4-methylphenyl)fluorene;1,4-bis(4-methylphenyl)-2,3,5,6-tetraphenylbenzene;2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
CID 157337445
2-methyl-7-(trifluoromethyl)spiro[fluorene-9,9'-xanthene]
CID 118965145
1-(2,4-dimethylphenyl)-2,4-dimethylbenzene;2-fluoro-1-(2-fluoro-4-methylphenyl)-4-methylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
CID 160749808
2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene
CID 20697245
3-methyl-2'-phenylspiro[fluorene-9,9'-xanthene]
CID 170243199
9,9-bis(4-methylphenyl)fluorene;2,4-dimethyl-1-[4-[4-[4-methyl-2-(trifluoromethyl)phenoxy]phenyl]phenoxy]benzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene;4-methyl-N-[3-methyl-4-[4-[(4-methylbenzoyl)amino]-2-(trifluoromethyl)phenyl]phenyl]benzamide;molecular hydrogen
CID 162136634
4-(2,4-dimethylphenyl)-3-(trifluoromethyl)aniline;5-[9-(1,3-dioxo-2-benzofuran-5-yl)fluoren-9-yl]-2-benzofuran-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione
CID 167647753
2,7-bis(trifluoromethyl)spiro[fluorene-9,9'-xanthene]
CID 118965533
1-[4-[4-(2,4-dimethylphenyl)phenoxy]-2,3,5,6-tetrafluorophenyl]-2,3,5,6-tetrafluoro-4-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(4-methylphenoxy)phenyl]phenoxy]phenyl]propan-2-yl]phenoxy]benzene
CID 126730752
2,7-dimethylspiro[fluorene-9,9'-xanthene]
CID 58250911
1-[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)phenyl]propan-2-yl]-4-methylbenzene
CID 143291553
N-(4-tert-butylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
CID 90153715

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene?
The IUPAC name of 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene (CID 54012927) is 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene.
What is the SMILES notation for 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene?
The canonical SMILES for 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene is Cc1c(-c2ccccc2)cc(-c2cc(-c3ccccc3)c(C)c(-c3ccccc3)c2)cc1-c1ccccc1.Cc1cc(F)c(-c2c(F)cc(C)cc2F)c(F)c1.Cc1ccc(-c2ccc(C)cc2C(F)(F)F)c(C(F)(F)F)c1.Cc1ccc(-c2ccc(C)cc2OC(F)(F)F)c(C)c1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc2c(c1)Oc1cc(C)ccc1C21c2ccccc2-c2ccccc21.
What is the InChIKey of 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene?
The InChIKey is KTQGQFQNONXOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30.C27H20O.C17H14F6.C16H12F6.C16H15F3O.C14H10F4/c1-27-35(29-15-7-3-8-16-29)23-33(24-36(27)30-17-9-4-10-18-30)34-25-37(31-19-11-5-12-20-31)28(2)38(26-34)32-21-13-6-14-22-32;1-17-11-13-23-25(15-17)28-26-16-18(2)12-14-24(26)27(23)21-9-5-3-7-19(21)20-8-4-6-10-22(20)27;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-9-3-5-11(13(7-9)15(17,18)19)12-6-4-10(2)8-14(12)16(20,21)22;1-10-4-6-13(12(3)8-10)14-7-5-11(2)9-15(14)20-16(17,18)19;1-7-3-9(15)13(10(16)4-7)14-11(17)5-8(2)6-12(14)18/h3-26H,1-2H3;3-16H,1-2H3;3-10H,1-2H3;3-8H,1-2H3;4-9H,1-3H3;3-6H,1-2H3.
What are the key properties of 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene?
2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene has a molecular weight of 2032.18 g/mol, XLogP of 38.84, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoro-4-methylphenyl)-1,3-difluoro-5-methylbenzene;2,4-dimethyl-1-[4-methyl-2-(trifluoromethoxy)phenyl]benzene;3',6'-dimethylspiro[fluorene-9,9'-xanthene];1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;2-methyl-5-(4-methyl-3,5-diphenylphenyl)-1,3-diphenylbenzene;4-methyl-1-[4-methyl-2-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene is sourced from PubChem (CID 54012927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).