3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine
TL;DR: 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine (CAS 96540-74-8) is a chemical compound with molecular formula C6H10N2O and molecular weight 126.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-nitroso-3,6-dihydro-2H-pyridine
Also Known As: 3-methyl-1-nitroso-1,2,3,6-tetrahydropyridine, 3-methyl-1-nitroso-3,6-dihydro-2H-pyridine, Pyridine, 1,2,3,6-tetrahydro-3-methyl-1-nitroso-
| Molecular Formula | C6H10N2O |
|---|---|
| Molecular Weight | 126.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.079315 |
| Heavy Atoms | 9 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 96540-74-8 |
|---|---|
| SMILES | CC1CN(CC=C1)N=O |
| InChIKey | LZLPRAJXUGVUMU-UHFFFAOYSA-N |
Product Overview
3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine (CAS 96540-74-8), with molecular formula C6H10N2O and molecular weight 126.08 g/mol. IUPAC: 3-methyl-1-nitroso-3,6-dihydro-2H-pyridine.
Chemical Property Profile of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine
Property Insights of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine. With a topological polar surface area (TPSA) of 32.7 Ų, 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine?
The CAS number of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine is 96540-74-8.
What is the molecular formula of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine?
The molecular formula of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine is C6H10N2O.
What is the molecular weight of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine?
The molecular weight of 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine is 126.08 g/mol.
Where can I buy 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine?
You can request a quote for 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-nitroso-1,2,3,6-tetrahydropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.