1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene

C18H22O — CID 15254143

IUPAC1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene
SMILESCc1ccc(COCc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C18H22O/c1-13-5-7-17(15(3)9-13)11-19-12-18-8-6-14(2)10-16(18)4/h5-10H,11-12H2,1-4H3
InChIKeyLWOMITAZCBZKKN-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.64
Rot. Bonds4

About 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene

1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene (PubChem CID 15254143) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene.

Molecular Properties

Compound Name1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene
PubChem CID15254143
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene
SMILESCc1ccc(COCc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C18H22O/c1-13-5-7-17(15(3)9-13)11-19-12-18-8-6-14(2)10-16(18)4/h5-10H,11-12H2,1-4H3
InChIKeyLWOMITAZCBZKKN-UHFFFAOYSA-N
XLogP4.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene?
The IUPAC name of 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene (CID 15254143) is 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene.
What is the SMILES notation for 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene?
The canonical SMILES for 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene is Cc1ccc(COCc2ccc(C)cc2C)c(C)c1.
What is the InChIKey of 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene?
The InChIKey is LWOMITAZCBZKKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-13-5-7-17(15(3)9-13)11-19-12-18-8-6-14(2)10-16(18)4/h5-10H,11-12H2,1-4H3.
What are the key properties of 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene?
1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene has a molecular weight of 254.37 g/mol, XLogP of 4.64, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dimethylphenyl)methoxymethyl]-2,4-dimethylbenzene is sourced from PubChem (CID 15254143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).