RefChem:1068642
TL;DR: RefChem:1068642 (CAS 139886-08-1) is a chemical compound with molecular formula C12H23ClN2O and molecular weight 246.14989 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-methoxy-1-(1-pentyl-3,6-dihydro-2H-pyridin-5-yl)methanimine;hydrochloride
Also Known As: (E)-1-Pentyl-1,2,5,6-tetrahydro-3-pyridinecarboxaldehyde O-methyloxime monohydrochloride, 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-pentyl-, O-methyloxime, monohydrochloride, (E)-
Technical Specifications
| Molecular Formula | C12H23ClN2O |
| Molecular Weight | 246.14989 g/mol |
| XLogP | 2.8627 |
| Topological Polar Surface Area (TPSA) | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.14989 Da |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
| SMILES | CCCCCN1CCC=C(C1)/C=N/OC.Cl |
| InChIKey | VQILMRFMKNFMOQ-RSGUCCNWSA-N |
Chemical Property Profile of RefChem:1068642
Property Insights of RefChem:1068642
The XLogP value of 2.8627 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068642. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:1068642 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068642 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:1068642?
The CAS number of RefChem:1068642 is 139886-08-1.
What is the molecular formula of RefChem:1068642?
The molecular formula of RefChem:1068642 is C12H23ClN2O.
What is the molecular weight of RefChem:1068642?
The molecular weight of RefChem:1068642 is 246.14989 g/mol.
Where can I buy RefChem:1068642?
You can request a quote for RefChem:1068642 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1068642?
Yes, CoreyChem provides custom synthesis services for RefChem:1068642 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.