4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene

C15H16S — CID 143364745

IUPAC4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene
SMILESCSc1cc(C)ccc1-c1ccc(C)cc1
InChIInChI=1S/C15H16S/c1-11-4-7-13(8-5-11)14-9-6-12(2)10-15(14)16-3/h4-10H,1-3H3
InChIKeyUVRUIZNPZITXJR-UHFFFAOYSA-N
MW228.36 g/mol
LogP4.69
Rot. Bonds2

About 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene

4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene (PubChem CID 143364745) has the molecular formula C15H16S and a molecular weight of 228.36 g/mol. Its IUPAC name is 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene.

Molecular Properties

Compound Name4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene
PubChem CID143364745
Molecular FormulaC15H16S
Molecular Weight228.36 g/mol
Exact Mass228.10
IUPAC Name4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene
SMILESCSc1cc(C)ccc1-c1ccc(C)cc1
InChIInChI=1S/C15H16S/c1-11-4-7-13(8-5-11)14-9-6-12(2)10-15(14)16-3/h4-10H,1-3H3
InChIKeyUVRUIZNPZITXJR-UHFFFAOYSA-N
XLogP4.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene?
The IUPAC name of 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene (CID 143364745) is 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene.
What is the SMILES notation for 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene?
The canonical SMILES for 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene is CSc1cc(C)ccc1-c1ccc(C)cc1.
What is the InChIKey of 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene?
The InChIKey is UVRUIZNPZITXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16S/c1-11-4-7-13(8-5-11)14-9-6-12(2)10-15(14)16-3/h4-10H,1-3H3.
What are the key properties of 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene?
4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene has a molecular weight of 228.36 g/mol, XLogP of 4.69, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylphenyl)-2-methylsulfanylbenzene is sourced from PubChem (CID 143364745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).