2,4-diethyl-1-(2-methylphenyl)benzene

C17H20 — CID 142070386

IUPAC2,4-diethyl-1-(2-methylphenyl)benzene
SMILESCCc1ccc(-c2ccccc2C)c(CC)c1
InChIInChI=1S/C17H20/c1-4-14-10-11-17(15(5-2)12-14)16-9-7-6-8-13(16)3/h6-12H,4-5H2,1-3H3
InChIKeyQFZVRBRWKNTAQL-UHFFFAOYSA-N
MW224.35 g/mol
LogP4.79
Rot. Bonds3

About 2,4-diethyl-1-(2-methylphenyl)benzene

2,4-diethyl-1-(2-methylphenyl)benzene (PubChem CID 142070386) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 2,4-diethyl-1-(2-methylphenyl)benzene.

Molecular Properties

Compound Name2,4-diethyl-1-(2-methylphenyl)benzene
PubChem CID142070386
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name2,4-diethyl-1-(2-methylphenyl)benzene
SMILESCCc1ccc(-c2ccccc2C)c(CC)c1
InChIInChI=1S/C17H20/c1-4-14-10-11-17(15(5-2)12-14)16-9-7-6-8-13(16)3/h6-12H,4-5H2,1-3H3
InChIKeyQFZVRBRWKNTAQL-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-1-(2-methylphenyl)benzene?
The IUPAC name of 2,4-diethyl-1-(2-methylphenyl)benzene (CID 142070386) is 2,4-diethyl-1-(2-methylphenyl)benzene.
What is the SMILES notation for 2,4-diethyl-1-(2-methylphenyl)benzene?
The canonical SMILES for 2,4-diethyl-1-(2-methylphenyl)benzene is CCc1ccc(-c2ccccc2C)c(CC)c1.
What is the InChIKey of 2,4-diethyl-1-(2-methylphenyl)benzene?
The InChIKey is QFZVRBRWKNTAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20/c1-4-14-10-11-17(15(5-2)12-14)16-9-7-6-8-13(16)3/h6-12H,4-5H2,1-3H3.
What are the key properties of 2,4-diethyl-1-(2-methylphenyl)benzene?
2,4-diethyl-1-(2-methylphenyl)benzene has a molecular weight of 224.35 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-1-(2-methylphenyl)benzene is sourced from PubChem (CID 142070386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).