TL;DR: 1,3-Di-(1-pyrenyl)propane (CAS 61549-24-4) is a chemical compound with molecular formula C35H24 and molecular weight 444.1878 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-pyren-1-ylpropyl)pyrene
Also Known As: 1,3-Dipyrenylpropane, DPYP, 1,3-Dipp, Py(CH2)3Py, 1,3-Di-(1-pyrenyl)propane
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C35H24 |
| Molecular Weight | 444.1878 g/mol |
| XLogP | 10.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.1878 Da |
| Heavy Atoms | 35 |
| Complexity | 691.0 |
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5 |
| InChIKey | OUEIPKXVZRHNIB-UHFFFAOYSA-N |
The XLogP value of 10.9 indicates that 1,3-Di-(1-pyrenyl)propane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Di-(1-pyrenyl)propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Di-(1-pyrenyl)propane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,3-Di-(1-pyrenyl)propane is 61549-24-4.
The molecular formula of 1,3-Di-(1-pyrenyl)propane is C35H24.
The molecular weight of 1,3-Di-(1-pyrenyl)propane is 444.1878 g/mol.
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