1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene

C110H130 — CID 162003142

IUPAC1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
SMILESCc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1cccc(-c2cccc(C)c2C)c1C
InChIInChI=1S/3C16H18.3C14H16.2C10H14/c1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h3*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3
InChIKeyYSMFIQLEIHOCNF-UHFFFAOYSA-N
MW1452.25 g/mol
LogP31.82
Rot. Bonds3

About 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene

1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene (PubChem CID 162003142) has the molecular formula C110H130 and a molecular weight of 1452.25 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
PubChem CID162003142
Molecular FormulaC110H130
Molecular Weight1452.25 g/mol
Exact Mass1451.02
IUPAC Name1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
SMILESCc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1cccc(-c2cccc(C)c2C)c1C
InChIInChI=1S/3C16H18.3C14H16.2C10H14/c1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h3*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3
InChIKeyYSMFIQLEIHOCNF-UHFFFAOYSA-N
XLogP31.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms110
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001452.25
LogP ≤ 531.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The IUPAC name of 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene (CID 162003142) is 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The canonical SMILES for 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene is Cc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1cccc(-c2cccc(C)c2C)c1C.
What is the InChIKey of 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The InChIKey is YSMFIQLEIHOCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C16H18.3C14H16.2C10H14/c1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h3*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3.
What are the key properties of 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene has a molecular weight of 1452.25 g/mol, XLogP of 31.82, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene is sourced from PubChem (CID 162003142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).