1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene

C24H26O2 — CID 135298981

IUPAC1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene
SMILESCCOc1ccc(C)cc1-c1cc(C)c(-c2ccccc2C)cc1OC
InChIInChI=1S/C24H26O2/c1-6-26-23-12-11-16(2)13-21(23)22-14-18(4)20(15-24(22)25-5)19-10-8-7-9-17(19)3/h7-15H,6H2,1-5H3
InChIKeyANWXIVJIAWBJOJ-UHFFFAOYSA-N
MW346.47 g/mol
LogP6.35
Rot. Bonds5

About 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene

1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene (PubChem CID 135298981) has the molecular formula C24H26O2 and a molecular weight of 346.47 g/mol. Its IUPAC name is 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene.

Molecular Properties

Compound Name1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene
PubChem CID135298981
Molecular FormulaC24H26O2
Molecular Weight346.47 g/mol
Exact Mass346.19
IUPAC Name1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene
SMILESCCOc1ccc(C)cc1-c1cc(C)c(-c2ccccc2C)cc1OC
InChIInChI=1S/C24H26O2/c1-6-26-23-12-11-16(2)13-21(23)22-14-18(4)20(15-24(22)25-5)19-10-8-7-9-17(19)3/h7-15H,6H2,1-5H3
InChIKeyANWXIVJIAWBJOJ-UHFFFAOYSA-N
XLogP6.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 56.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene?
The IUPAC name of 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene (CID 135298981) is 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene.
What is the SMILES notation for 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene?
The canonical SMILES for 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene is CCOc1ccc(C)cc1-c1cc(C)c(-c2ccccc2C)cc1OC.
What is the InChIKey of 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene?
The InChIKey is ANWXIVJIAWBJOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O2/c1-6-26-23-12-11-16(2)13-21(23)22-14-18(4)20(15-24(22)25-5)19-10-8-7-9-17(19)3/h7-15H,6H2,1-5H3.
What are the key properties of 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene?
1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene has a molecular weight of 346.47 g/mol, XLogP of 6.35, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene is sourced from PubChem (CID 135298981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).