6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine
TL;DR: 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine (CAS 58532-43-7) is a chemical compound with molecular formula C18H18BrNO2 and molecular weight 359.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2-bromoethyl)-15,17-dioxa-9-azatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaene
Also Known As: Cid 6453645, 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine, 6-(2-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz[c,e]azocine, (1,3)Benzodioxolo(5,6-e)(2)benzazocine, 6-(2-bromoethyl)-5,6,7,8-tetrahydro-, 6-(Beta-bromoethyl)-10,11-methylenedioxy-5,6,7,8- tetrahydrodibenz(c,e)azocine
| Molecular Formula | C18H18BrNO2 |
|---|---|
| Molecular Weight | 359.05 g/mol |
| LogP | 3.8353 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.0521 |
| Heavy Atoms | 22 |
| Complexity | 701.4817 |
Chemical Identifiers
| CAS Number | 58532-43-7 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C2C3=CC4=C(C=C31)OCO4)CCBr |
Product Overview
6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine (CAS 58532-43-7), with molecular formula C18H18BrNO2 and molecular weight 359.05 g/mol. IUPAC: 9-(2-bromoethyl)-15,17-dioxa-9-azatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaene.
Chemical Property Profile of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine
Property Insights of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine
The XLogP value of 3.8353 indicates that 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine 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 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine?
The CAS number of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine is 58532-43-7.
What is the molecular formula of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine?
The molecular formula of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine is C18H18BrNO2.
What is the molecular weight of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine?
The molecular weight of 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine is 359.05 g/mol.
Where can I buy 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine?
You can request a quote for 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine?
Yes, KEHONG BIO provides custom synthesis services for 6-(beta-Bromoethyl)-10,11-methylenedioxy-5,6,7,8-tetrahydrodibenz(c,e)azocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.