TL;DR: 6-Octenal, 3,7-dimethyl-, oxime (CAS 22457-25-6) is a chemical compound with molecular formula C10H19NO and molecular weight 169.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,7-dimethyloct-6-enylidene)hydroxylamine
Also Known As: Citronellal oxime, Citronellaloxim, 6-Octenal, 3,7-dimethyl-, oxime, 3,7-Dimethyloct-6-enal oxime, 6-Octenaldoxime, 3,7-dimethyl-
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H19NO |
| Molecular Weight | 169.14667 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 169.14667 Da |
| Heavy Atoms | 12 |
| Complexity | 157.0 |
| SMILES | CC(CCC=C(C)C)CC=NO |
| InChIKey | JUCCIEVMICHZPK-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 6-Octenal, 3,7-dimethyl-, oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.6 Ų, 6-Octenal, 3,7-dimethyl-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Octenal, 3,7-dimethyl-, oxime has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-Octenal, 3,7-dimethyl-, oxime is 22457-25-6.
The molecular formula of 6-Octenal, 3,7-dimethyl-, oxime is C10H19NO.
The molecular weight of 6-Octenal, 3,7-dimethyl-, oxime is 169.14667 g/mol.
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