1-ethenyl-2,4-dipropylbenzene

C14H20 — CID 22033822

IUPAC1-ethenyl-2,4-dipropylbenzene
SMILESC=Cc1ccc(CCC)cc1CCC
InChIInChI=1S/C14H20/c1-4-7-12-9-10-13(6-3)14(11-12)8-5-2/h6,9-11H,3-5,7-8H2,1-2H3
InChIKeyCCYFATPNAXTAFW-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.23
Rot. Bonds5

About 1-ethenyl-2,4-dipropylbenzene

1-ethenyl-2,4-dipropylbenzene (PubChem CID 22033822) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-ethenyl-2,4-dipropylbenzene.

Molecular Properties

Compound Name1-ethenyl-2,4-dipropylbenzene
PubChem CID22033822
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name1-ethenyl-2,4-dipropylbenzene
SMILESC=Cc1ccc(CCC)cc1CCC
InChIInChI=1S/C14H20/c1-4-7-12-9-10-13(6-3)14(11-12)8-5-2/h6,9-11H,3-5,7-8H2,1-2H3
InChIKeyCCYFATPNAXTAFW-UHFFFAOYSA-N
XLogP4.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,4-dipropylbenzene?
The IUPAC name of 1-ethenyl-2,4-dipropylbenzene (CID 22033822) is 1-ethenyl-2,4-dipropylbenzene.
What is the SMILES notation for 1-ethenyl-2,4-dipropylbenzene?
The canonical SMILES for 1-ethenyl-2,4-dipropylbenzene is C=Cc1ccc(CCC)cc1CCC.
What is the InChIKey of 1-ethenyl-2,4-dipropylbenzene?
The InChIKey is CCYFATPNAXTAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-4-7-12-9-10-13(6-3)14(11-12)8-5-2/h6,9-11H,3-5,7-8H2,1-2H3.
What are the key properties of 1-ethenyl-2,4-dipropylbenzene?
1-ethenyl-2,4-dipropylbenzene has a molecular weight of 188.31 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,4-dipropylbenzene is sourced from PubChem (CID 22033822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).