butane;1,4-dimethyl-2-(2-methylphenyl)benzene

C19H26 — CID 142975298

IUPACbutane;1,4-dimethyl-2-(2-methylphenyl)benzene
SMILESCCCC.Cc1ccc(C)c(-c2ccccc2C)c1
InChIInChI=1S/C15H16.C4H10/c1-11-8-9-13(3)15(10-11)14-7-5-4-6-12(14)2;1-3-4-2/h4-10H,1-3H3;3-4H2,1-2H3
InChIKeyDCPPFHJWZVKATH-UHFFFAOYSA-N
MW254.42 g/mol
LogP6.09
Rot. Bonds2

About butane;1,4-dimethyl-2-(2-methylphenyl)benzene

butane;1,4-dimethyl-2-(2-methylphenyl)benzene (PubChem CID 142975298) has the molecular formula C19H26 and a molecular weight of 254.42 g/mol. Its IUPAC name is butane;1,4-dimethyl-2-(2-methylphenyl)benzene.

Molecular Properties

Compound Namebutane;1,4-dimethyl-2-(2-methylphenyl)benzene
PubChem CID142975298
Molecular FormulaC19H26
Molecular Weight254.42 g/mol
Exact Mass254.20
IUPAC Namebutane;1,4-dimethyl-2-(2-methylphenyl)benzene
SMILESCCCC.Cc1ccc(C)c(-c2ccccc2C)c1
InChIInChI=1S/C15H16.C4H10/c1-11-8-9-13(3)15(10-11)14-7-5-4-6-12(14)2;1-3-4-2/h4-10H,1-3H3;3-4H2,1-2H3
InChIKeyDCPPFHJWZVKATH-UHFFFAOYSA-N
XLogP6.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.42
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of butane;1,4-dimethyl-2-(2-methylphenyl)benzene?
The IUPAC name of butane;1,4-dimethyl-2-(2-methylphenyl)benzene (CID 142975298) is butane;1,4-dimethyl-2-(2-methylphenyl)benzene.
What is the SMILES notation for butane;1,4-dimethyl-2-(2-methylphenyl)benzene?
The canonical SMILES for butane;1,4-dimethyl-2-(2-methylphenyl)benzene is CCCC.Cc1ccc(C)c(-c2ccccc2C)c1.
What is the InChIKey of butane;1,4-dimethyl-2-(2-methylphenyl)benzene?
The InChIKey is DCPPFHJWZVKATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16.C4H10/c1-11-8-9-13(3)15(10-11)14-7-5-4-6-12(14)2;1-3-4-2/h4-10H,1-3H3;3-4H2,1-2H3.
What are the key properties of butane;1,4-dimethyl-2-(2-methylphenyl)benzene?
butane;1,4-dimethyl-2-(2-methylphenyl)benzene has a molecular weight of 254.42 g/mol, XLogP of 6.09, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;1,4-dimethyl-2-(2-methylphenyl)benzene is sourced from PubChem (CID 142975298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).