1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene

C164H156O4 — CID 157496457

IUPAC1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene
SMILESCc1c(-c2ccccc2)ccc(-c2ccccc2)c1C.Cc1cc(-c2ccccc2)c(C)cc1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(-c3cccc(C)c3)cc2)cc1.Cc1ccc(-c2cccc(C)c2)cc1.Cc1ccc(-c2ccccc2C)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2ccccc2)cc1C.Cc1cccc(Oc2cccc(C)c2)c1
InChIInChI=1S/4C20H18.4C14H14O.2C14H14/c1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-15-13-20(18-11-7-4-8-12-18)16(2)14-19(15)17-9-5-3-6-10-17;1-15-16(2)20(18-11-7-4-8-12-18)14-13-19(15)17-9-5-3-6-10-17;1-15-6-8-17(9-7-15)18-10-12-19(13-11-18)20-5-3-4-16(2)14-20;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)15-14-8-4-6-12(2)10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-11-8-9-14(10-12(11)2)15-13-6-4-3-5-7-13;1-11-6-8-13(9-7-11)14-5-3-4-12(2)10-14;1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2/h4*3-14H,1-2H3;4*3-10H,1-2H3;2*3-10H,1-2H3
InChIKeyBXWUUJHOIPHPAN-UHFFFAOYSA-N
MW2191.05 g/mol
LogP46.87
Rot. Bonds18

About 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene

1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene (PubChem CID 157496457) has the molecular formula C164H156O4 and a molecular weight of 2191.05 g/mol. Its IUPAC name is 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene.

Molecular Properties

Compound Name1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene
PubChem CID157496457
Molecular FormulaC164H156O4
Molecular Weight2191.05 g/mol
Exact Mass2189.20
IUPAC Name1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene
SMILESCc1c(-c2ccccc2)ccc(-c2ccccc2)c1C.Cc1cc(-c2ccccc2)c(C)cc1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(-c3cccc(C)c3)cc2)cc1.Cc1ccc(-c2cccc(C)c2)cc1.Cc1ccc(-c2ccccc2C)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2ccccc2)cc1C.Cc1cccc(Oc2cccc(C)c2)c1
InChIInChI=1S/4C20H18.4C14H14O.2C14H14/c1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-15-13-20(18-11-7-4-8-12-18)16(2)14-19(15)17-9-5-3-6-10-17;1-15-16(2)20(18-11-7-4-8-12-18)14-13-19(15)17-9-5-3-6-10-17;1-15-6-8-17(9-7-15)18-10-12-19(13-11-18)20-5-3-4-16(2)14-20;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)15-14-8-4-6-12(2)10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-11-8-9-14(10-12(11)2)15-13-6-4-3-5-7-13;1-11-6-8-13(9-7-11)14-5-3-4-12(2)10-14;1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2/h4*3-14H,1-2H3;4*3-10H,1-2H3;2*3-10H,1-2H3
InChIKeyBXWUUJHOIPHPAN-UHFFFAOYSA-N
XLogP46.87
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms168
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002191.05
LogP ≤ 546.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene with MolForge

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Related Compounds

1-methyl-2-[4-[4-(3-methylphenyl)phenoxy]phenyl]benzene
CID 70651586
1,4-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,5-dimethylnaphthalene;1,7-dimethylnaphthalene;1,8-dimethylnaphthalene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1,2-xylene;1,3-xylene;1,4-xylene
CID 159867775
1,4-bis(4-methylphenyl)benzene;1-(2,4-dimethylphenyl)-2,4-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene
CID 158917367
1,4-bis(3-methylphenyl)benzene;1,2-dimethyl-4-phenylbenzene;2,4-dimethyl-1-phenylbenzene;1-methyl-2-(3-methylphenyl)benzene;1-methyl-3-(3-methylphenyl)benzene;1-methyl-2-[2-(4-methylphenyl)phenyl]benzene;1-methyl-2-[4-(3-methylphenyl)phenyl]benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1-methyl-4-[2-(3-methylphenyl)phenyl]benzene
CID 162149152
1-methyl-2-[4-[4-(3-methylphenyl)phenoxy]phenyl]benzene;1-methyl-4-[3-[3-(4-methylphenyl)phenoxy]phenyl]benzene;1-methyl-2-[4-[4-(3-methylphenyl)phenyl]sulfanylphenyl]benzene;1-methyl-3-[4-[3-(4-methylphenyl)phenyl]sulfanylphenyl]benzene;1-methyl-4-[3-[3-(4-methylphenyl)phenyl]sulfanylphenyl]benzene;1-methyl-4-[4-[4-(4-methylphenyl)phenyl]sulfanylphenyl]benzene;1-methyl-3-(3-methylphenyl)sulfanylbenzene;1-methyl-3-(4-methylphenyl)sulfanylbenzene;bis(1-methyl-4-(4-methylphenyl)sulfanylbenzene)
CID 159119776
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
1-methyl-2,4-diphenylbenzene;1-methyl-3,5-diphenylbenzene;4-methyl-1,2-diphenylbenzene;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene;1-methyl-4-phenylbenzene;1-(3-methylphenyl)-3,5-diphenylbenzene;1-methyl-3-(3-phenylphenyl)benzene
CID 161146851
1-methyl-2-[3-(4-phenylphenyl)phenyl]benzene;1-methyl-2-phenyl-4-(4-phenylphenyl)benzene;1-methyl-3-[2-(4-phenylphenyl)phenyl]benzene;1-methyl-3-[3-(4-phenylphenyl)phenyl]benzene;1-methyl-3-phenyl-5-(4-phenylphenyl)benzene;1-methyl-4-[3-(4-phenylphenyl)phenyl]benzene
CID 159186914
2-methyl-1,3-diphenylbenzene;1-methyl-2-[3-(4-phenylphenyl)phenyl]benzene;1-methyl-3-[2-(4-phenylphenyl)phenyl]benzene;1-methyl-3-[3-(4-phenylphenyl)phenyl]benzene;1-methyl-3-phenyl-5-(4-phenylphenyl)benzene;1-methyl-4-[2-(4-phenylphenyl)phenyl]benzene;1-methyl-4-[3-(4-phenylphenyl)phenyl]benzene
CID 165013304
bis(1,2-dimethyl-4-(2-methylphenyl)benzene);bis(1,2-dimethyl-4-phenylbenzene);1-(3,4-dimethylphenyl)-2,4-dimethylbenzene;bis(1,2,3,5-tetramethylbenzene);1,2,3-trimethylbenzene;bis(1,2,3-trimethyl-5-phenylbenzene)
CID 161130606
ethane;1-methyl-2-(3-phenylphenyl)benzene;1-methyl-2-(4-phenylphenyl)benzene;1-methyl-3-(2-phenylphenyl)benzene;1-methyl-3-(3-phenylphenyl)benzene;1-methyl-3-(4-phenylphenyl)benzene;1-methyl-4-(3-phenylphenyl)benzene
CID 158292689
1,3-bis(4-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-2-[3-(4-methylphenyl)phenyl]benzene;1-methyl-2-[4-(4-methylphenyl)phenyl]benzene;1-methyl-3-[3-(4-methylphenyl)phenyl]benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1,3-xylene
CID 158071150

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene?
The IUPAC name of 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene (CID 157496457) is 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene.
What is the SMILES notation for 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene?
The canonical SMILES for 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene is Cc1c(-c2ccccc2)ccc(-c2ccccc2)c1C.Cc1cc(-c2ccccc2)c(C)cc1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(-c3cccc(C)c3)cc2)cc1.Cc1ccc(-c2cccc(C)c2)cc1.Cc1ccc(-c2ccccc2C)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2ccccc2)cc1C.Cc1cccc(Oc2cccc(C)c2)c1.
What is the InChIKey of 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene?
The InChIKey is BXWUUJHOIPHPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C20H18.4C14H14O.2C14H14/c1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-15-13-20(18-11-7-4-8-12-18)16(2)14-19(15)17-9-5-3-6-10-17;1-15-16(2)20(18-11-7-4-8-12-18)14-13-19(15)17-9-5-3-6-10-17;1-15-6-8-17(9-7-15)18-10-12-19(13-11-18)20-5-3-4-16(2)14-20;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)15-14-8-4-6-12(2)10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-11-8-9-14(10-12(11)2)15-13-6-4-3-5-7-13;1-11-6-8-13(9-7-11)14-5-3-4-12(2)10-14;1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2/h4*3-14H,1-2H3;4*3-10H,1-2H3;2*3-10H,1-2H3.
What are the key properties of 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene?
1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene has a molecular weight of 2191.05 g/mol, XLogP of 46.87, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(4-methylphenyl)benzene;1,4-dimethyl-2,5-diphenylbenzene;2,3-dimethyl-1,4-diphenylbenzene;1,2-dimethyl-4-phenoxybenzene;1-methyl-3-(3-methylphenoxy)benzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene is sourced from PubChem (CID 157496457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).