1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene

C18H18 — CID 156753876

IUPAC1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene
SMILESC=Cc1ccc(-c2ccc(CC)cc2)cc1C=C
InChIInChI=1S/C18H18/c1-4-14-7-9-17(10-8-14)18-12-11-15(5-2)16(6-3)13-18/h5-13H,2-4H2,1H3
InChIKeyAUGOVAJURFENFP-UHFFFAOYSA-N
MW234.34 g/mol
LogP5.20
Rot. Bonds4

About 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene

1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene (PubChem CID 156753876) has the molecular formula C18H18 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene.

Molecular Properties

Compound Name1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene
PubChem CID156753876
Molecular FormulaC18H18
Molecular Weight234.34 g/mol
Exact Mass234.14
IUPAC Name1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene
SMILESC=Cc1ccc(-c2ccc(CC)cc2)cc1C=C
InChIInChI=1S/C18H18/c1-4-14-7-9-17(10-8-14)18-12-11-15(5-2)16(6-3)13-18/h5-13H,2-4H2,1H3
InChIKeyAUGOVAJURFENFP-UHFFFAOYSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500234.34
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene?
The IUPAC name of 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene (CID 156753876) is 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene.
What is the SMILES notation for 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene?
The canonical SMILES for 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene is C=Cc1ccc(-c2ccc(CC)cc2)cc1C=C.
What is the InChIKey of 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene?
The InChIKey is AUGOVAJURFENFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18/c1-4-14-7-9-17(10-8-14)18-12-11-15(5-2)16(6-3)13-18/h5-13H,2-4H2,1H3.
What are the key properties of 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene?
1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene has a molecular weight of 234.34 g/mol, XLogP of 5.20, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene is sourced from PubChem (CID 156753876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).