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)

C133H150 — CID 161130606

IUPACbis(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)
SMILESCc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(C)c(C)c(C)c1.Cc1cc(C)c(C)c(C)c1.Cc1ccc(-c2ccc(C)c(C)c2)c(C)c1.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1cccc(C)c1C
InChIInChI=1S/C16H18.4C15H16.2C14H14.2C10H14.C9H12/c1-11-5-8-16(14(4)9-11)15-7-6-12(2)13(3)10-15;2*1-11-8-9-14(10-13(11)3)15-7-5-4-6-12(15)2;2*1-11-9-15(10-12(2)13(11)3)14-7-5-4-6-8-14;2*1-11-8-9-14(10-12(11)2)13-6-4-3-5-7-13;2*1-7-5-8(2)10(4)9(3)6-7;1-7-5-4-6-8(2)9(7)3/h5-10H,1-4H3;4*4-10H,1-3H3;2*3-10H,1-2H3;2*5-6H,1-4H3;4-6H,1-3H3
InChIKeyUMDAXEQYLSYAIE-UHFFFAOYSA-N
MW1748.66 g/mol
LogP38.10
Rot. Bonds7

About 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)

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) (PubChem CID 161130606) has the molecular formula C133H150 and a molecular weight of 1748.66 g/mol. Its IUPAC name is 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).

Molecular Properties

Compound Namebis(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)
PubChem CID161130606
Molecular FormulaC133H150
Molecular Weight1748.66 g/mol
Exact Mass1747.17
IUPAC Namebis(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)
SMILESCc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(C)c(C)c(C)c1.Cc1cc(C)c(C)c(C)c1.Cc1ccc(-c2ccc(C)c(C)c2)c(C)c1.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1cccc(C)c1C
InChIInChI=1S/C16H18.4C15H16.2C14H14.2C10H14.C9H12/c1-11-5-8-16(14(4)9-11)15-7-6-12(2)13(3)10-15;2*1-11-8-9-14(10-13(11)3)15-7-5-4-6-12(15)2;2*1-11-9-15(10-12(2)13(11)3)14-7-5-4-6-8-14;2*1-11-8-9-14(10-12(11)2)13-6-4-3-5-7-13;2*1-7-5-8(2)10(4)9(3)6-7;1-7-5-4-6-8(2)9(7)3/h5-10H,1-4H3;4*4-10H,1-3H3;2*3-10H,1-2H3;2*5-6H,1-4H3;4-6H,1-3H3
InChIKeyUMDAXEQYLSYAIE-UHFFFAOYSA-N
XLogP38.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms133
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001748.66
LogP ≤ 538.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 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) with MolForge

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Related Compounds

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
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
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
1,2,3,5-tetramethylbenzene;1,2,4,5-tetramethylbenzene;toluene;1,2,3-trimethylbenzene;1,2,4-trimethylbenzene;1,3,5-trimethylbenzene;1,2-xylene;1,3-xylene;1,4-xylene
CID 159639769
1,2-bis[3-(2-methylphenyl)phenyl]benzene;1,3-bis[3-(2-methylphenyl)phenyl]benzene;1,4-bis[3-(2-methylphenyl)phenyl]benzene;1,3-bis[3-(4-methylphenyl)phenyl]-5-phenylbenzene;1,4-bis[3-(4-methylphenyl)phenyl]-2-phenylbenzene;1,2-dimethyl-4,5-bis[3-(4-methylphenyl)phenyl]benzene
CID 158504879
1,1'-biphenyl;ethane;naphthalene;1,2,3-trimethylbenzene;1,2,4-trimethylbenzene;1,3,5-trimethylbenzene
CID 159707891
1,2,3,4-tetramethylbenzene;1,2,3,5-tetramethylbenzene;1,2,4,5-tetramethylbenzene;toluene;1,2,3-trimethylbenzene;tris(1,2,4-trimethylbenzene);1,3,5-trimethylbenzene;1,3-xylene;1,4-xylene
CID 158819449
1-(2,4-dimethylphenyl)-2,4-dimethylbenzene;1-methyl-2-(2-methylphenyl)benzene;1-methyl-2-(3-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene
CID 160676393
1-(2-methylphenyl)-3,5-diphenylbenzene;1-(3-methylphenyl)-3,5-diphenylbenzene;1-(4-methylphenyl)-3,5-diphenylbenzene
CID 163934955
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
1,3-dimethyl-2-(4-methylphenyl)benzene;1,3-dimethyl-5-(4-methylphenyl)benzene;2,4-dimethyl-1-(4-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-4-(4-methylphenyl)benzene;1,3,5-trimethyl-2-(4-methylphenyl)benzene
CID 161447273

Frequently Asked Questions

What is the IUPAC name of 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)?
The IUPAC name of 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) is 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).
What is the SMILES notation for 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)?
The canonical SMILES for 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) is Cc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(-c2ccccc2)cc(C)c1C.Cc1cc(C)c(C)c(C)c1.Cc1cc(C)c(C)c(C)c1.Cc1ccc(-c2ccc(C)c(C)c2)c(C)c1.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1ccc(-c2ccccc2C)cc1C.Cc1cccc(C)c1C.
What is the InChIKey of 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)?
The InChIKey is UMDAXEQYLSYAIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18.4C15H16.2C14H14.2C10H14.C9H12/c1-11-5-8-16(14(4)9-11)15-7-6-12(2)13(3)10-15;2*1-11-8-9-14(10-13(11)3)15-7-5-4-6-12(15)2;2*1-11-9-15(10-12(2)13(11)3)14-7-5-4-6-8-14;2*1-11-8-9-14(10-12(11)2)13-6-4-3-5-7-13;2*1-7-5-8(2)10(4)9(3)6-7;1-7-5-4-6-8(2)9(7)3/h5-10H,1-4H3;4*4-10H,1-3H3;2*3-10H,1-2H3;2*5-6H,1-4H3;4-6H,1-3H3.
What are the key properties of 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)?
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) has a molecular weight of 1748.66 g/mol, XLogP of 38.10, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 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) is sourced from PubChem (CID 161130606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).