1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene

C135H180Br4 — CID 158380579

About 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene

1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene (PubChem CID 158380579) has the molecular formula C135H180Br4 and a molecular weight of 2122.54 g/mol. Its IUPAC name is 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene.

Molecular Properties

• Compound Name: 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene
• PubChem CID: 158380579
• Molecular Formula: C135H180Br4
• Molecular Weight: 2122.54 g/mol
• Exact Mass: 2117.08
• IUPAC Name: 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene
• SMILES: C.C.C.C.C.C.C.C.Cc1c(C)c(Br)c(-c2c(Br)c(C)c(C)c(C)c2Br)c(Br)c1C.Cc1cc(-c2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1cc(C(C)(C)c2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C)c(C)c1.Cc1ccc(C)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1cccc(C)c1
• InChI: InChI=1S/C21H28.C18H18Br4.C18H22.C16H18.C15H16.C14H14.C9H12.2C8H10.8CH4/c1-13-9-19(10-14(2)17(13)5)21(7,8)20-11-15(3)18(6)16(4)12-20;1-7-9(3)15(19)13(16(20)10(7)4)14-17(21)11(5)8(2)12(6)18(14)22;1-11-7-17(8-12(2)15(11)5)18-9-13(3)16(6)14(4)10-18;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)11-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-4-5-8(2)9(3)6-7;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;;;;;;;;/h9-12H,1-8H3;1-6H3;7-10H,1-6H3;5-10H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;4-6H,1-3H3;2*3-6H,1-2H3;8*1H4
• InChIKey: GVSVPGRFMJXRNZ-UHFFFAOYSA-N
• XLogP: 44.08
• TPSA: 0.00 Ų
• Rotatable Bonds: 8
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2122.54
LogP ≤ 5	44.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene?

The IUPAC name of 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene (CID 158380579) is 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene.

What is the SMILES notation for 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene?

The canonical SMILES for 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene is C.C.C.C.C.C.C.C.Cc1c(C)c(Br)c(-c2c(Br)c(C)c(C)c(C)c2Br)c(Br)c1C.Cc1cc(-c2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1cc(C(C)(C)c2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C)c(C)c1.Cc1ccc(C)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1cccc(C)c1.

What is the InChIKey of 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene?

The InChIKey is GVSVPGRFMJXRNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28.C18H18Br4.C18H22.C16H18.C15H16.C14H14.C9H12.2C8H10.8CH4/c1-13-9-19(10-14(2)17(13)5)21(7,8)20-11-15(3)18(6)16(4)12-20;1-7-9(3)15(19)13(16(20)10(7)4)14-17(21)11(5)8(2)12(6)18(14)22;1-11-7-17(8-12(2)15(11)5)18-9-13(3)16(6)14(4)10-18;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)11-15-9-5-13(2)6-10-15;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-4-5-8(2)9(3)6-7;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;;;;;;;;/h9-12H,1-8H3;1-6H3;7-10H,1-6H3;5-10H,1-4H3;3-10H,11H2,1-2H3;3-10H,1-2H3;4-6H,1-3H3;2*3-6H,1-2H3;8*1H4.

What are the key properties of 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene?

1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene has a molecular weight of 2122.54 g/mol, XLogP of 44.08, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-dibromo-2-(2,6-dibromo-3,4,5-trimethylphenyl)-4,5,6-trimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;methane;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1,2,4-trimethylbenzene;1,2,3-trimethyl-5-(3,4,5-trimethylphenyl)benzene;1,2,3-trimethyl-5-[2-(3,4,5-trimethylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene is sourced from PubChem (CID 158380579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).