1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene

C21H18 — CID 123748481

IUPAC1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
SMILESC=Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C21H18/c1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18/h3-15H,1H2,2H3
InChIKeyBXVKAITWFJUEGM-UHFFFAOYSA-N
MW270.38 g/mol
LogP5.97
Rot. Bonds3

About 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene

1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene (PubChem CID 123748481) has the molecular formula C21H18 and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene.

Molecular Properties

Compound Name1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
PubChem CID123748481
Molecular FormulaC21H18
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Name1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
SMILESC=Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C21H18/c1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18/h3-15H,1H2,2H3
InChIKeyBXVKAITWFJUEGM-UHFFFAOYSA-N
XLogP5.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.38
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 174976037
CID 174976037
1-ethenyl-4-methylbenzene;methane
CID 142136023
1-ethenyl-4-methylbenzene;methanamine
CID 23466173
bis(1-ethenyl-4-methylbenzene);formaldehyde
CID 144930982
1-ethenyl-4-(4-methylphenyl)benzene;hexane
CID 142178486
1-ethenyl-4-methylbenzene;styrene
CID 159659441
1,3-bis(ethenyl)-5-methylbenzene;1-ethenyl-4-methylbenzene
CID 158777597
(4-ethenylphenyl)-bis(4-methylphenyl)bismuthane
CID 11477443
dihydroxy(oxo)phosphanium;1-ethenyl-4-methylbenzene
CID 175432319
1-ethenyl-4-methylbenzene;2-methylbuta-1,3-diene;2-methylprop-1-ene
CID 159294849
1-ethenyl-3-methyl-5-(4-methylphenyl)benzene
CID 167311921
anthracene;1-ethenyl-4-methylbenzene
CID 174555561

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene?
The IUPAC name of 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene (CID 123748481) is 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene.
What is the SMILES notation for 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene?
The canonical SMILES for 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene is C=Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.
What is the InChIKey of 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene?
The InChIKey is BXVKAITWFJUEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18/c1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18/h3-15H,1H2,2H3.
What are the key properties of 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene?
1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene has a molecular weight of 270.38 g/mol, XLogP of 5.97, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene is sourced from PubChem (CID 123748481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).