1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate

C265H378O20 — CID 162119460

About 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate

1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate (PubChem CID 162119460) has the molecular formula C265H378O20 and a molecular weight of 3883.92 g/mol. Its IUPAC name is 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate.

Molecular Properties

• Compound Name: 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate
• PubChem CID: 162119460
• Molecular Formula: C265H378O20
• Molecular Weight: 3883.92 g/mol
• Exact Mass: 3880.86
• IUPAC Name: 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate
• SMILES: C=O.C=O.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1CCC(C2CCC(C)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C(=O)Oc2ccc(-c3ccccc3)cc2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(COOc2ccc(C(OO)c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(C)cc2)cc1.Cc1ccc(OC(=O)c2ccc(OC(=O)c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1
• InChI: InChI=1S/C22H18O4.C22H22O4.C21H18O3.C21H18O2.C20H16O2.C20H18.C15H14O2.C14H14O.C14H26.2C14H20.C14H14.26C2H6.2CH2O/c1-15-3-7-17(8-4-15)21(23)26-20-13-9-18(10-14-20)22(24)25-19-11-5-16(2)6-12-19;1-16-3-7-18(8-4-16)15-24-26-21-13-11-20(12-14-21)22(25-23)19-9-5-17(2)6-10-19;1-15-3-9-18(10-4-15)23-19-13-7-17(8-14-19)21(22)24-20-11-5-16(2)6-12-20;1-15-3-7-17(8-4-15)18-9-11-19(12-10-18)21(22)23-20-13-5-16(2)6-14-20;1-15-7-9-18(10-8-15)20(21)22-19-13-11-17(12-14-19)16-5-3-2-4-6-16;1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;4*1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;28*1-2/h3-14H,1-2H3;3-14,22-23H,15H2,1-2H3;3-14H,1-2H3;3-14H,1-2H3;2-14H,1H3;3-14H,1-2H3;3-10H,1-2H3;3-10H,1-2H3;11-14H,3-10H2,1-2H3;2*3-4,7-8,12,14H,5-6,9-10H2,1-2H3;3-10H,1-2H3;26*1-2H3;2*1H2
• InChIKey: ZHFGYGIAVYHMQN-UHFFFAOYSA-N
• XLogP: 82.27
• TPSA: 258.32 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 31
• Heavy Atoms: 285
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3883.92
LogP ≤ 5	82.27
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate?

The IUPAC name of 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate (CID 162119460) is 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate.

What is the SMILES notation for 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate?

The canonical SMILES for 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate is C=O.C=O.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1CCC(C2CCC(C)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C(=O)Oc2ccc(-c3ccccc3)cc2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(COOc2ccc(C(OO)c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(C)cc2)cc1.Cc1ccc(OC(=O)c2ccc(OC(=O)c3ccc(C)cc3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.

What is the InChIKey of 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate?

The InChIKey is ZHFGYGIAVYHMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18O4.C22H22O4.C21H18O3.C21H18O2.C20H16O2.C20H18.C15H14O2.C14H14O.C14H26.2C14H20.C14H14.26C2H6.2CH2O/c1-15-3-7-17(8-4-15)21(23)26-20-13-9-18(10-14-20)22(24)25-19-11-5-16(2)6-12-19;1-16-3-7-18(8-4-16)15-24-26-21-13-11-20(12-14-21)22(25-23)19-9-5-17(2)6-10-19;1-15-3-9-18(10-4-15)23-19-13-7-17(8-14-19)21(22)24-20-11-5-16(2)6-12-20;1-15-3-7-17(8-4-15)18-9-11-19(12-10-18)21(22)23-20-13-5-16(2)6-14-20;1-15-7-9-18(10-8-15)20(21)22-19-13-11-17(12-14-19)16-5-3-2-4-6-16;1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;4*1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;28*1-2/h3-14H,1-2H3;3-14,22-23H,15H2,1-2H3;3-14H,1-2H3;3-14H,1-2H3;2-14H,1H3;3-14H,1-2H3;3-10H,1-2H3;3-10H,1-2H3;11-14H,3-10H2,1-2H3;2*3-4,7-8,12,14H,5-6,9-10H2,1-2H3;3-10H,1-2H3;26*1-2H3;2*1H2.

What are the key properties of 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate?

1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate has a molecular weight of 3883.92 g/mol, XLogP of 82.27, 31 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1,4-bis(4-methylphenyl)benzene;ethane;formaldehyde;1-[hydroperoxy-(4-methylphenyl)methyl]-4-[(4-methylphenyl)methylperoxy]benzene;bis(1-methyl-4-(4-methylcyclohexyl)benzene);1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;[4-(4-methylphenoxy)carbonylphenyl] 4-methylbenzoate;(4-methylphenyl) 4-methylbenzoate;(4-methylphenyl) 4-(4-methylphenoxy)benzoate;(4-methylphenyl) 4-(4-methylphenyl)benzoate;(4-phenylphenyl) 4-methylbenzoate is sourced from PubChem (CID 162119460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).