1-Nitrosoazacyclotridecane
TL;DR: 1-Nitrosoazacyclotridecane (CAS 40580-89-0) is a chemical compound with molecular formula C12H24N2O and molecular weight 212.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroso-azacyclotridecane
Also Known As: 1-Nitrosoazacyclotridecane, NDMI, Nitrosododecamethylenimine, N-Nitrosododecamethyleneimine, N-Nitrosododecamethylenimine
| Molecular Formula | C12H24N2O |
|---|---|
| Molecular Weight | 212.19 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.18886 |
| Heavy Atoms | 15 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 40580-89-0 |
|---|---|
| SMILES | C1CCCCCCN(CCCCC1)N=O |
| InChIKey | HQHACWYQWDKBOZ-UHFFFAOYSA-N |
Product Overview
1-Nitrosoazacyclotridecane (CAS 40580-89-0), with molecular formula C12H24N2O and molecular weight 212.19 g/mol. IUPAC: 1-nitroso-azacyclotridecane.
Chemical Property Profile of 1-Nitrosoazacyclotridecane
Property Insights of 1-Nitrosoazacyclotridecane
The XLogP value of 4.2 indicates that 1-Nitrosoazacyclotridecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 1-Nitrosoazacyclotridecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitrosoazacyclotridecane 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 1-Nitrosoazacyclotridecane?
The CAS number of 1-Nitrosoazacyclotridecane is 40580-89-0.
What is the molecular formula of 1-Nitrosoazacyclotridecane?
The molecular formula of 1-Nitrosoazacyclotridecane is C12H24N2O.
What is the molecular weight of 1-Nitrosoazacyclotridecane?
The molecular weight of 1-Nitrosoazacyclotridecane is 212.19 g/mol.
Where can I buy 1-Nitrosoazacyclotridecane?
You can request a quote for 1-Nitrosoazacyclotridecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitrosoazacyclotridecane?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitrosoazacyclotridecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.