About bis(1-ethenyl-4-methylbenzene);formaldehyde
bis(1-ethenyl-4-methylbenzene);formaldehyde (PubChem CID 144930982) has the molecular formula C20H24O2
and a molecular weight of 296.41 g/mol. Its IUPAC name is bis(1-ethenyl-4-methylbenzene);formaldehyde.
Molecular Properties
| Compound Name | bis(1-ethenyl-4-methylbenzene);formaldehyde |
| PubChem CID | 144930982 |
| Molecular Formula | C20H24O2 |
| Molecular Weight | 296.41 g/mol |
| Exact Mass | 296.18 |
| IUPAC Name | bis(1-ethenyl-4-methylbenzene);formaldehyde |
| SMILES | C=Cc1ccc(C)cc1.C=Cc1ccc(C)cc1.C=O.C=O |
| InChI | InChI=1S/2C9H10.2CH2O/c2*1-3-9-6-4-8(2)5-7-9;2*1-2/h2*3-7H,1H2,2H3;2*1H2 |
| InChIKey | AORPIBCYGRKXKZ-UHFFFAOYSA-N |
| XLogP | 4.91 |
| TPSA | 34.14 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 296.41 |
| LogP ≤ 5 | 4.91 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of bis(1-ethenyl-4-methylbenzene);formaldehyde?
The IUPAC name of bis(1-ethenyl-4-methylbenzene);formaldehyde (CID 144930982) is bis(1-ethenyl-4-methylbenzene);formaldehyde.
What is the SMILES notation for bis(1-ethenyl-4-methylbenzene);formaldehyde?
The canonical SMILES for bis(1-ethenyl-4-methylbenzene);formaldehyde is C=Cc1ccc(C)cc1.C=Cc1ccc(C)cc1.C=O.C=O.
What is the InChIKey of bis(1-ethenyl-4-methylbenzene);formaldehyde?
The InChIKey is AORPIBCYGRKXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H10.2CH2O/c2*1-3-9-6-4-8(2)5-7-9;2*1-2/h2*3-7H,1H2,2H3;2*1H2.
What are the key properties of bis(1-ethenyl-4-methylbenzene);formaldehyde?
bis(1-ethenyl-4-methylbenzene);formaldehyde has a molecular weight of 296.41 g/mol, XLogP of 4.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-ethenyl-4-methylbenzene);formaldehyde is sourced from PubChem (CID 144930982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).