![8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane structure](/static/products/904/904696-75-9.png)
8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
TL;DR: 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane (CAS 904696-75-9) is a chemical compound with molecular formula C14H18BrNO2 and molecular weight 311.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(3-bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
Also Known As: 8-[(3-bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane, 8-(3-bromobenzyl)-1,4-dioxa-8-azaspiro[4.5]decane
| Molecular Formula | C14H18BrNO2 |
|---|---|
| Molecular Weight | 311.05 g/mol |
| LogP | 2.788 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.0521 |
| Heavy Atoms | 18 |
| Complexity | 408.00995 |
Chemical Identifiers
| CAS Number | 904696-75-9 |
|---|---|
| SMILES | C1CN(CCC12OCCO2)CC3=CC(=CC=C3)Br |
Product Overview
8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane (CAS 904696-75-9), with molecular formula C14H18BrNO2 and molecular weight 311.05 g/mol. IUPAC: 8-[(3-bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane.
Chemical Property Profile of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
Property Insights of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
The XLogP value of 2.788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane. With a topological polar surface area (TPSA) of 21.7 Ų, 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane 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 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The CAS number of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is 904696-75-9.
What is the molecular formula of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The molecular formula of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is C14H18BrNO2.
What is the molecular weight of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The molecular weight of 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is 311.05 g/mol.
Where can I buy 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
You can request a quote for 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
Yes, KEHONG BIO provides custom synthesis services for 8-[(3-Bromophenyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.