TL;DR: Dodec-4-enal (CAS 30390-51-3) is a chemical compound with molecular formula C12H22O and molecular weight 182.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dodec-4-enal
Also Known As: 4-Dodecenal, Dodec-4-en-1-al, (Z)-4-Dodecenal, 4-Dodecen-1-al, DODEC-4-ENAL
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H22O |
| Molecular Weight | 182.16707 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 182.16707 Da |
| Heavy Atoms | 13 |
| Complexity | 127.0 |
| SMILES | CCCCCCCC=CCCC=O |
| InChIKey | MMCDSVCBSAMNPL-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that Dodec-4-enal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Dodec-4-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodec-4-enal has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dodec-4-enal is 30390-51-3.
The molecular formula of Dodec-4-enal is C12H22O.
The molecular weight of Dodec-4-enal is 182.16707 g/mol.
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