9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene

C219H224F6O5S — CID 157167119

IUPAC9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene
SMILESCC.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(C)cc3)c2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)c(C)c3)c3ccccc3-c3ccccc32)cc1C.Cc1ccc(C2(c3ccc(C)cc3)CCCCC2)cc1.Cc1ccc(C2(c3ccc(C)cc3)OC(=O)c3ccccc32)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1cccc(C)c1
InChIInChI=1S/C29H26.C27H22.C26H30.C22H18O2.C20H24.C17H14F6.C17H20.C15H16.C14H14O2S.C14H14O.2C8H10.C2H6/c1-19-13-15-23(17-21(19)3)29(24-16-14-20(2)22(4)18-24)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-10-14-21(15-11-19)25(3,4)23-8-7-9-24(18-23)26(5,6)22-16-12-20(2)13-17-22;1-15-7-11-17(12-8-15)22(18-13-9-16(2)10-14-18)20-6-4-3-5-19(20)21(23)24-22;1-16-6-10-18(11-7-16)20(14-4-3-5-15-20)19-12-8-17(2)9-13-19;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;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-2/h5-18H,1-4H3;3-18H,1-2H3;7-18H,1-6H3;3-14H,1-2H3;6-13H,3-5,14-15H2,1-2H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;1-2H3
InChIKeyANAVMACTQFURFP-UHFFFAOYSA-N
MW3082.25 g/mol
LogP58.33
Rot. Bonds22

About 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene

9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene (PubChem CID 157167119) has the molecular formula C219H224F6O5S and a molecular weight of 3082.25 g/mol. Its IUPAC name is 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene.

Molecular Properties

Compound Name9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene
PubChem CID157167119
Molecular FormulaC219H224F6O5S
Molecular Weight3082.25 g/mol
Exact Mass3079.69
IUPAC Name9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene
SMILESCC.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(C)cc3)c2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)c(C)c3)c3ccccc3-c3ccccc32)cc1C.Cc1ccc(C2(c3ccc(C)cc3)CCCCC2)cc1.Cc1ccc(C2(c3ccc(C)cc3)OC(=O)c3ccccc32)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1cccc(C)c1
InChIInChI=1S/C29H26.C27H22.C26H30.C22H18O2.C20H24.C17H14F6.C17H20.C15H16.C14H14O2S.C14H14O.2C8H10.C2H6/c1-19-13-15-23(17-21(19)3)29(24-16-14-20(2)22(4)18-24)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-10-14-21(15-11-19)25(3,4)23-8-7-9-24(18-23)26(5,6)22-16-12-20(2)13-17-22;1-15-7-11-17(12-8-15)22(18-13-9-16(2)10-14-18)20-6-4-3-5-19(20)21(23)24-22;1-16-6-10-18(11-7-16)20(14-4-3-5-15-20)19-12-8-17(2)9-13-19;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;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-2/h5-18H,1-4H3;3-18H,1-2H3;7-18H,1-6H3;3-14H,1-2H3;6-13H,3-5,14-15H2,1-2H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;1-2H3
InChIKeyANAVMACTQFURFP-UHFFFAOYSA-N
XLogP58.33
TPSA69.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds22
Heavy Atoms231
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003082.25
LogP ≤ 558.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene with MolForge

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CID 140175439

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene?
The IUPAC name of 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene (CID 157167119) is 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene.
What is the SMILES notation for 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene?
The canonical SMILES for 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene is CC.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2cccc(C(C)(C)c3ccc(C)cc3)c2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)c(C)c3)c3ccccc3-c3ccccc32)cc1C.Cc1ccc(C2(c3ccc(C)cc3)CCCCC2)cc1.Cc1ccc(C2(c3ccc(C)cc3)OC(=O)c3ccccc32)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1cccc(C)c1.
What is the InChIKey of 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene?
The InChIKey is ANAVMACTQFURFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26.C27H22.C26H30.C22H18O2.C20H24.C17H14F6.C17H20.C15H16.C14H14O2S.C14H14O.2C8H10.C2H6/c1-19-13-15-23(17-21(19)3)29(24-16-14-20(2)22(4)18-24)27-11-7-5-9-25(27)26-10-6-8-12-28(26)29;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-10-14-21(15-11-19)25(3,4)23-8-7-9-24(18-23)26(5,6)22-16-12-20(2)13-17-22;1-15-7-11-17(12-8-15)22(18-13-9-16(2)10-14-18)20-6-4-3-5-19(20)21(23)24-22;1-16-6-10-18(11-7-16)20(14-4-3-5-15-20)19-12-8-17(2)9-13-19;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;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-2/h5-18H,1-4H3;3-18H,1-2H3;7-18H,1-6H3;3-14H,1-2H3;6-13H,3-5,14-15H2,1-2H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;1-2H3.
What are the key properties of 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene?
9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene has a molecular weight of 3082.25 g/mol, XLogP of 58.33, 22 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(3,4-dimethylphenyl)fluorene;3,3-bis(4-methylphenyl)-2-benzofuran-1-one;9,9-bis(4-methylphenyl)fluorene;1,3-bis[2-(4-methylphenyl)propan-2-yl]benzene;ethane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,3-xylene;1,4-xylene is sourced from PubChem (CID 157167119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).