1,3-bis[2-(4-ethenylphenyl)ethyl]benzene

C26H26 — CID 20738929

IUPAC1,3-bis[2-(4-ethenylphenyl)ethyl]benzene
SMILESC=Cc1ccc(CCc2cccc(CCc3ccc(C=C)cc3)c2)cc1
InChIInChI=1S/C26H26/c1-3-21-8-12-23(13-9-21)16-18-25-6-5-7-26(20-25)19-17-24-14-10-22(4-2)11-15-24/h3-15,20H,1-2,16-19H2
InChIKeyNVPIFCPRQWYBOP-UHFFFAOYSA-N
MW338.49 g/mol
LogP6.54
Rot. Bonds8

About 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene

1,3-bis[2-(4-ethenylphenyl)ethyl]benzene (PubChem CID 20738929) has the molecular formula C26H26 and a molecular weight of 338.49 g/mol. Its IUPAC name is 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1,3-bis[2-(4-ethenylphenyl)ethyl]benzene
PubChem CID20738929
Molecular FormulaC26H26
Molecular Weight338.49 g/mol
Exact Mass338.20
IUPAC Name1,3-bis[2-(4-ethenylphenyl)ethyl]benzene
SMILESC=Cc1ccc(CCc2cccc(CCc3ccc(C=C)cc3)c2)cc1
InChIInChI=1S/C26H26/c1-3-21-8-12-23(13-9-21)16-18-25-6-5-7-26(20-25)19-17-24-14-10-22(4-2)11-15-24/h3-15,20H,1-2,16-19H2
InChIKeyNVPIFCPRQWYBOP-UHFFFAOYSA-N
XLogP6.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.49
LogP ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-bis[2-(3-ethenylphenyl)ethyl]benzene;1-ethenyl-4-[2-[3-[2-(3-ethenylphenyl)ethyl]phenyl]ethyl]benzene
CID 175399717
1-ethenyl-3-[6-(4-ethenylphenyl)hexyl]benzene
CID 91200175
1-ethenyl-4-(5-phenylpentyl)benzene
CID 151483185
N-(4-ethenylphenyl)-4-[2-[4-(N-(4-ethenylphenyl)anilino)phenyl]ethyl]-N-phenylaniline
CID 89417368
2-[2-(4-ethenylphenyl)ethyl]-1,3,5-trimethylbenzene
CID 21344469
1-ethenyl-4-[[4-[[4-[(4-ethenylphenyl)methyl]phenyl]methyl]phenyl]methyl]benzene
CID 163649628
1,4-bis[(4-ethenylphenyl)methyl]benzene
CID 20738932
1,3-bis(2-phenylethyl)benzene;1,4-bis(2-phenylethyl)benzene;1,3-bis(3-phenylpropyl)benzene;1,4-bis(3-phenylpropyl)benzene
CID 161066607
3-(4-ethenylphenyl)propane-1-thiol
CID 59552728
(3-ethenylphenyl)methylphosphanium chloride
CID 159346927
1-ethenyl-4-(2-methoxyethyl)benzene
CID 66598261
1-(2-ethenoxyethyl)-4-ethenylbenzene
CID 23031073

Frequently Asked Questions

What is the IUPAC name of 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene?
The IUPAC name of 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene (CID 20738929) is 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene.
What is the SMILES notation for 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene?
The canonical SMILES for 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene is C=Cc1ccc(CCc2cccc(CCc3ccc(C=C)cc3)c2)cc1.
What is the InChIKey of 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene?
The InChIKey is NVPIFCPRQWYBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26/c1-3-21-8-12-23(13-9-21)16-18-25-6-5-7-26(20-25)19-17-24-14-10-22(4-2)11-15-24/h3-15,20H,1-2,16-19H2.
What are the key properties of 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene?
1,3-bis[2-(4-ethenylphenyl)ethyl]benzene has a molecular weight of 338.49 g/mol, XLogP of 6.54, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[2-(4-ethenylphenyl)ethyl]benzene is sourced from PubChem (CID 20738929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).