RefChem:1068632
TL;DR: RefChem:1068632 (CAS 139886-02-5) is a chemical compound with molecular formula C9H17ClN2O and molecular weight 204.10294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methoxymethanimine;hydrochloride
Also Known As: 1-Ethyl-1,2,5,6-tetrahydropyridine-3-carboxaldehyde-O-methyloxime hydrochloride, 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-ethyl-, O-methyloxime, monohydrochloride, (E)-, (E)-1,2,5,6-Tetrahydro-1-ethyl-3-pyridinecarboxaldehyde O-methyloxime, monohydrochloride
Technical Specifications
| Molecular Formula | C9H17ClN2O |
| Molecular Weight | 204.10294 g/mol |
| XLogP | 1.6924 |
| Topological Polar Surface Area (TPSA) | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.10294 Da |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
| SMILES | CCN1CCC=C(C1)/C=N/OC.Cl |
| InChIKey | JOIOTJVXEGKVSU-HCUGZAAXSA-N |
Chemical Property Profile of RefChem:1068632
Property Insights of RefChem:1068632
The XLogP value of 1.6924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068632. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:1068632 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068632 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:1068632?
The CAS number of RefChem:1068632 is 139886-02-5.
What is the molecular formula of RefChem:1068632?
The molecular formula of RefChem:1068632 is C9H17ClN2O.
What is the molecular weight of RefChem:1068632?
The molecular weight of RefChem:1068632 is 204.10294 g/mol.
Where can I buy RefChem:1068632?
You can request a quote for RefChem:1068632 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1068632?
Yes, CoreyChem provides custom synthesis services for RefChem:1068632 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.