RefChem:1068641
TL;DR: RefChem:1068641 (CAS 139886-28-5) is a chemical compound with molecular formula C7H13ClN2O and molecular weight 176.07164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(NE)-N-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methylidene]hydroxylamine;hydrochloride
Also Known As: (E)-1,2,5,6-Tetrahydro-1-methyl-3-pyridinecarboxaldehyde oxime, monohydrochloride, 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-methyl-, oxime, monohydrochloride, (E)-
Technical Specifications
| Molecular Formula | C7H13ClN2O |
| Molecular Weight | 176.07164 g/mol |
| XLogP | 1.1301 |
| Topological Polar Surface Area (TPSA) | 35.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.07164 Da |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
| SMILES | CN1CCC=C(C1)/C=N/O.Cl |
| InChIKey | JVRHEKQBYWMFRH-HAAWTFQLSA-N |
Chemical Property Profile of RefChem:1068641
Property Insights of RefChem:1068641
The XLogP value of 1.1301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068641. With a topological polar surface area (TPSA) of 35.8 Ų, RefChem:1068641 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068641 has 2 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:1068641?
The CAS number of RefChem:1068641 is 139886-28-5.
What is the molecular formula of RefChem:1068641?
The molecular formula of RefChem:1068641 is C7H13ClN2O.
What is the molecular weight of RefChem:1068641?
The molecular weight of RefChem:1068641 is 176.07164 g/mol.
Where can I buy RefChem:1068641?
You can request a quote for RefChem:1068641 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1068641?
Yes, CoreyChem provides custom synthesis services for RefChem:1068641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.