2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene

C18H22 — CID 171799163

IUPAC2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene
SMILESCc1cc(C)cc(-c2c(C)cc(C)c(C)c2C)c1
InChIInChI=1S/C18H22/c1-11-7-12(2)9-17(8-11)18-14(4)10-13(3)15(5)16(18)6/h7-10H,1-6H3
InChIKeyMADQAUMFHQNBMY-UHFFFAOYSA-N
MW238.37 g/mol
LogP5.20
Rot. Bonds1

About 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene

2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene (PubChem CID 171799163) has the molecular formula C18H22 and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene
PubChem CID171799163
Molecular FormulaC18H22
Molecular Weight238.37 g/mol
Exact Mass238.17
IUPAC Name2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene
SMILESCc1cc(C)cc(-c2c(C)cc(C)c(C)c2C)c1
InChIInChI=1S/C18H22/c1-11-7-12(2)9-17(8-11)18-14(4)10-13(3)15(5)16(18)6/h7-10H,1-6H3
InChIKeyMADQAUMFHQNBMY-UHFFFAOYSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.37
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2,3,5-tetramethyl-4-[4-(4-methylphenyl)phenyl]benzene
CID 144579538
1,2,3,5-tetramethyl-4-phenylbenzene
CID 14973977
[4-(3,5-dimethylphenyl)phenyl]-(2,3,4,6-tetramethylphenyl)-(2,4,6-trimethylphenyl)borane
CID 163998435
4-(3,5-dimethylphenyl)-3,5-dimethylbenzonitrile
CID 90908719
4-(2,3,5,6-tetramethylphenyl)aniline
CID 54912488
5-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol
CID 101299652
1,3-dimethyl-5-phenylbenzene;bis(yttrium)
CID 59217667
1-[4-[3,5-bis(4-methylphenyl)phenyl]phenyl]-3,5-dimethylbenzene
CID 58892382
1,2,3,4-tetramethylbenzene;bis(1,2,3,5-tetramethylbenzene)
CID 158514008
1,2,3,4,5,7,8-heptamethyl-9H-fluorene;bis(1,2,3,4,5,6-hexamethylbenzene);1,2,4,5,7,8-hexamethyl-9H-fluorene;bis(1,2,3,4,5,6,7,8-octamethyl-9H-fluorene);bis(1,2,3,4,5-pentamethylbenzene)
CID 159697118
5-(2,4,6-trimethylphenyl)benzene-1,3-diol
CID 101299183
formaldehyde;1,2,3,4,5-pentamethylbenzene
CID 162197138

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene?
The IUPAC name of 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene (CID 171799163) is 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene?
The canonical SMILES for 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene is Cc1cc(C)cc(-c2c(C)cc(C)c(C)c2C)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene?
The InChIKey is MADQAUMFHQNBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22/c1-11-7-12(2)9-17(8-11)18-14(4)10-13(3)15(5)16(18)6/h7-10H,1-6H3.
What are the key properties of 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene?
2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene has a molecular weight of 238.37 g/mol, XLogP of 5.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-1,3,4,5-tetramethylbenzene is sourced from PubChem (CID 171799163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).