2-ethoxy-4-ethyl-1-propylbenzene

C13H20O — CID 14665571

IUPAC2-ethoxy-4-ethyl-1-propylbenzene
SMILESCCCc1ccc(CC)cc1OCC
InChIInChI=1S/C13H20O/c1-4-7-12-9-8-11(5-2)10-13(12)14-6-3/h8-10H,4-7H2,1-3H3
InChIKeyXJZDPFNIOSVDEU-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.60
Rot. Bonds5

About 2-ethoxy-4-ethyl-1-propylbenzene

2-ethoxy-4-ethyl-1-propylbenzene (PubChem CID 14665571) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 2-ethoxy-4-ethyl-1-propylbenzene.

Molecular Properties

Compound Name2-ethoxy-4-ethyl-1-propylbenzene
PubChem CID14665571
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name2-ethoxy-4-ethyl-1-propylbenzene
SMILESCCCc1ccc(CC)cc1OCC
InChIInChI=1S/C13H20O/c1-4-7-12-9-8-11(5-2)10-13(12)14-6-3/h8-10H,4-7H2,1-3H3
InChIKeyXJZDPFNIOSVDEU-UHFFFAOYSA-N
XLogP3.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-ethyl-1-propylbenzene?
The IUPAC name of 2-ethoxy-4-ethyl-1-propylbenzene (CID 14665571) is 2-ethoxy-4-ethyl-1-propylbenzene.
What is the SMILES notation for 2-ethoxy-4-ethyl-1-propylbenzene?
The canonical SMILES for 2-ethoxy-4-ethyl-1-propylbenzene is CCCc1ccc(CC)cc1OCC.
What is the InChIKey of 2-ethoxy-4-ethyl-1-propylbenzene?
The InChIKey is XJZDPFNIOSVDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-4-7-12-9-8-11(5-2)10-13(12)14-6-3/h8-10H,4-7H2,1-3H3.
What are the key properties of 2-ethoxy-4-ethyl-1-propylbenzene?
2-ethoxy-4-ethyl-1-propylbenzene has a molecular weight of 192.30 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-ethyl-1-propylbenzene is sourced from PubChem (CID 14665571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).