![dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate structure](/static/products/6256/62562-92-9.webp)
dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate
TL;DR: dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate (CAS 62562-92-9) is a chemical compound with molecular formula C16H23NO6 and molecular weight 325.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate
Also Known As: dimethyl (5E,7E)-1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-, dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate
| Molecular Formula | C16H23NO6 |
|---|---|
| Molecular Weight | 325.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.15253 |
| Heavy Atoms | 23 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 62562-92-9 |
|---|---|
| SMILES | COC(=O)C1=CCCCN(C=C1C(=O)OC)CCC2OCCO2 |
| InChIKey | DJVZVMUZFWVTMY-UHFFFAOYSA-N |
Product Overview
dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate (CAS 62562-92-9), with molecular formula C16H23NO6 and molecular weight 325.15 g/mol. IUPAC: dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate.
Chemical Property Profile of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate
Property Insights of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate has 0 hydrogen bond donor(s) and 7 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 dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate?
The CAS number of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate is 62562-92-9.
What is the molecular formula of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate?
The molecular formula of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate is C16H23NO6.
What is the molecular weight of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate?
The molecular weight of dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate is 325.15 g/mol.
Where can I buy dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate?
You can request a quote for dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 1-[2-(1,3-dioxolan-2-yl)ethyl]-3,4-dihydro-2H-azocine-6,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.