1-ethyl-4-(4-ethylphenyl)-2-propylbenzene

C19H24 — CID 143540689

IUPAC1-ethyl-4-(4-ethylphenyl)-2-propylbenzene
SMILESCCCc1cc(-c2ccc(CC)cc2)ccc1CC
InChIInChI=1S/C19H24/c1-4-7-18-14-19(13-12-16(18)6-3)17-10-8-15(5-2)9-11-17/h8-14H,4-7H2,1-3H3
InChIKeyKLEJSUXRBGOTKN-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.43
Rot. Bonds5

About 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene

1-ethyl-4-(4-ethylphenyl)-2-propylbenzene (PubChem CID 143540689) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene.

Molecular Properties

Compound Name1-ethyl-4-(4-ethylphenyl)-2-propylbenzene
PubChem CID143540689
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Name1-ethyl-4-(4-ethylphenyl)-2-propylbenzene
SMILESCCCc1cc(-c2ccc(CC)cc2)ccc1CC
InChIInChI=1S/C19H24/c1-4-7-18-14-19(13-12-16(18)6-3)17-10-8-15(5-2)9-11-17/h8-14H,4-7H2,1-3H3
InChIKeyKLEJSUXRBGOTKN-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.40
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene?
The IUPAC name of 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene (CID 143540689) is 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene.
What is the SMILES notation for 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene?
The canonical SMILES for 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene is CCCc1cc(-c2ccc(CC)cc2)ccc1CC.
What is the InChIKey of 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene?
The InChIKey is KLEJSUXRBGOTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-4-7-18-14-19(13-12-16(18)6-3)17-10-8-15(5-2)9-11-17/h8-14H,4-7H2,1-3H3.
What are the key properties of 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene?
1-ethyl-4-(4-ethylphenyl)-2-propylbenzene has a molecular weight of 252.40 g/mol, XLogP of 5.43, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(4-ethylphenyl)-2-propylbenzene is sourced from PubChem (CID 143540689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).