RefChem:1068636
TL;DR: RefChem:1068636 (CAS 139886-26-3) is a chemical compound with molecular formula C11H19ClN2O and molecular weight 230.11859 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-[(E)-but-2-enoxy]-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine;hydrochloride
Also Known As: 1-Methyl-1,2,5,6-tetrahydropyridine-3-carboxaldehyde-O-2-butenyloxime hydrochloride, 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-methyl-, O-2-butenyloxime, monohydrochloride, (E,E)-
Technical Specifications
| Molecular Formula | C11H19ClN2O |
| Molecular Weight | 230.11859 g/mol |
| XLogP | 2.2486 |
| Topological Polar Surface Area (TPSA) | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.11859 Da |
| Heavy Atoms | 15 |
| Complexity | 244.0 |
| SMILES | C/C=C/CO/N=C/C1=CCCN(C1)C.Cl |
| InChIKey | MBQYVWAACFLRSI-ALRXLZRNSA-N |
Chemical Property Profile of RefChem:1068636
Property Insights of RefChem:1068636
The XLogP value of 2.2486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068636. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:1068636 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068636 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1068636?
The CAS number of RefChem:1068636 is 139886-26-3.
What is the molecular formula of RefChem:1068636?
The molecular formula of RefChem:1068636 is C11H19ClN2O.
What is the molecular weight of RefChem:1068636?
The molecular weight of RefChem:1068636 is 230.11859 g/mol.
Where can I buy RefChem:1068636?
You can request a quote for RefChem:1068636 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1068636?
Yes, CoreyChem provides custom synthesis services for RefChem:1068636 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.