bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide

C139H149F3O11S3 — CID 160759437

About bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide

bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide (PubChem CID 160759437) has the molecular formula C139H149F3O11S3 and a molecular weight of 2148.90 g/mol. Its IUPAC name is bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide.

Molecular Properties

• Compound Name: bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide
• PubChem CID: 160759437
• Molecular Formula: C139H149F3O11S3
• Molecular Weight: 2148.90 g/mol
• Exact Mass: 2147.02
• IUPAC Name: bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide
• SMILES: C.C.COc1cc(C)ccc1-c1ccc(C)cc1CO.Cc1cc2c(cc1C)S(=O)(=O)c1cc(C)c(C)cc1-2.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2ccc(C)cc2C(F)(F)F)c(C)c1.Cc1ccc(C(=O)c2ccc(C)cc2)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(OCOc2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1cccc(S(=O)(=O)c2cccc(C)c2)c1
• InChI: InChI=1S/C16H15F3.C16H16O2S.C16H18O2.C16H18.C15H16O2.C15H14O.C15H16.2C14H14O2S.2CH4/c1-10-4-6-13(12(3)8-10)14-7-5-11(2)9-15(14)16(17,18)19;1-9-5-13-14-6-10(2)12(4)8-16(14)19(17,18)15(13)7-11(9)3;1-11-4-6-14(13(8-11)10-17)15-7-5-12(2)9-16(15)18-3;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-12-3-7-14(8-4-12)16-11-17-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14;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;1-11-5-3-7-13(9-11)17(15,16)14-8-4-6-12(2)10-14;;/h4-9H,1-3H3;5-8H,1-4H3;4-9,17H,10H2,1-3H3;5-10H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;3-10H,11H2,1-2H3;2*3-10H,1-2H3;2*1H4
• InChIKey: RXWBISLIWRMEDS-UHFFFAOYSA-N
• XLogP: 35.78
• TPSA: 167.41 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 11
• Rotatable Bonds: 17
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2148.90
LogP ≤ 5	35.78
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide?

The IUPAC name of bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide (CID 160759437) is bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide.

What is the SMILES notation for bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide?

The canonical SMILES for bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide is C.C.COc1cc(C)ccc1-c1ccc(C)cc1CO.Cc1cc2c(cc1C)S(=O)(=O)c1cc(C)c(C)cc1-2.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2ccc(C)cc2C(F)(F)F)c(C)c1.Cc1ccc(C(=O)c2ccc(C)cc2)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(OCOc2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1cccc(S(=O)(=O)c2cccc(C)c2)c1.

What is the InChIKey of bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide?

The InChIKey is RXWBISLIWRMEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3.C16H16O2S.C16H18O2.C16H18.C15H16O2.C15H14O.C15H16.2C14H14O2S.2CH4/c1-10-4-6-13(12(3)8-10)14-7-5-11(2)9-15(14)16(17,18)19;1-9-5-13-14-6-10(2)12(4)8-16(14)19(17,18)15(13)7-11(9)3;1-11-4-6-14(13(8-11)10-17)15-7-5-12(2)9-16(15)18-3;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-12-3-7-14(8-4-12)16-11-17-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14;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;1-11-5-3-7-13(9-11)17(15,16)14-8-4-6-12(2)10-14;;/h4-9H,1-3H3;5-8H,1-4H3;4-9,17H,10H2,1-3H3;5-10H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;3-10H,11H2,1-2H3;2*3-10H,1-2H3;2*1H4.

What are the key properties of bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide?

bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide has a molecular weight of 2148.90 g/mol, XLogP of 35.78, 17 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-methylphenyl)methanone;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;[2-(2-methoxy-4-methylphenyl)-5-methylphenyl]methanol;1-methyl-4-[(4-methylphenoxy)methoxy]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;2,3,7,8-tetramethyldibenzothiophene 5,5-dioxide is sourced from PubChem (CID 160759437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).