1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene

C20H24 — CID 102082358

IUPAC1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene
SMILESC=C(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H24/c1-12-8-16(5)20(17(6)9-12)18(7)19-11-14(3)13(2)10-15(19)4/h8-11H,7H2,1-6H3
InChIKeyAZZTXUKSGFUOJU-UHFFFAOYSA-N
MW264.41 g/mol
LogP5.60
Rot. Bonds2

About 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene

1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene (PubChem CID 102082358) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene.

Molecular Properties

Compound Name1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene
PubChem CID102082358
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Name1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene
SMILESC=C(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H24/c1-12-8-16(5)20(17(6)9-12)18(7)19-11-14(3)13(2)10-15(19)4/h8-11H,7H2,1-6H3
InChIKeyAZZTXUKSGFUOJU-UHFFFAOYSA-N
XLogP5.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.41
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene?
The IUPAC name of 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene (CID 102082358) is 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene.
What is the SMILES notation for 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene?
The canonical SMILES for 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene is C=C(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C.
What is the InChIKey of 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene?
The InChIKey is AZZTXUKSGFUOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24/c1-12-8-16(5)20(17(6)9-12)18(7)19-11-14(3)13(2)10-15(19)4/h8-11H,7H2,1-6H3.
What are the key properties of 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene?
1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene has a molecular weight of 264.41 g/mol, XLogP of 5.60, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene is sourced from PubChem (CID 102082358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).