1,4-dibutyl-2-ethenylbenzene

C16H24 — CID 140596757

IUPAC1,4-dibutyl-2-ethenylbenzene
SMILESC=Cc1cc(CCCC)ccc1CCCC
InChIInChI=1S/C16H24/c1-4-7-9-14-11-12-16(10-8-5-2)15(6-3)13-14/h6,11-13H,3-5,7-10H2,1-2H3
InChIKeyZUDXJJSIPRDRFL-UHFFFAOYSA-N
MW216.37 g/mol
LogP5.01
Rot. Bonds7

About 1,4-dibutyl-2-ethenylbenzene

1,4-dibutyl-2-ethenylbenzene (PubChem CID 140596757) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 1,4-dibutyl-2-ethenylbenzene.

Molecular Properties

Compound Name1,4-dibutyl-2-ethenylbenzene
PubChem CID140596757
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name1,4-dibutyl-2-ethenylbenzene
SMILESC=Cc1cc(CCCC)ccc1CCCC
InChIInChI=1S/C16H24/c1-4-7-9-14-11-12-16(10-8-5-2)15(6-3)13-14/h6,11-13H,3-5,7-10H2,1-2H3
InChIKeyZUDXJJSIPRDRFL-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500216.37
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1,2-bis(ethenyl)-4-propylbenzene
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3-ethenyl-2,8-dioctyldibenzofuran
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2,4-dibutyl-N-(2,4-dibutylphenyl)aniline
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1-ethenyl-2,4-dipropylbenzene
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1-ethenyl-2-pentylbenzene
CID 22171756
4-(2-butoxyethyl)-1,2-bis(ethenyl)benzene
CID 142240951
2-ethenyl-1-ethyl-4-prop-2-enylbenzene
CID 123275619
acetonitrile;1-butyl-2-ethenylbenzene
CID 18674742
(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane
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Frequently Asked Questions

What is the IUPAC name of 1,4-dibutyl-2-ethenylbenzene?
The IUPAC name of 1,4-dibutyl-2-ethenylbenzene (CID 140596757) is 1,4-dibutyl-2-ethenylbenzene.
What is the SMILES notation for 1,4-dibutyl-2-ethenylbenzene?
The canonical SMILES for 1,4-dibutyl-2-ethenylbenzene is C=Cc1cc(CCCC)ccc1CCCC.
What is the InChIKey of 1,4-dibutyl-2-ethenylbenzene?
The InChIKey is ZUDXJJSIPRDRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-4-7-9-14-11-12-16(10-8-5-2)15(6-3)13-14/h6,11-13H,3-5,7-10H2,1-2H3.
What are the key properties of 1,4-dibutyl-2-ethenylbenzene?
1,4-dibutyl-2-ethenylbenzene has a molecular weight of 216.37 g/mol, XLogP of 5.01, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dibutyl-2-ethenylbenzene is sourced from PubChem (CID 140596757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).