![But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane structure](/static/products/845/84509-05-7.png)
But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
TL;DR: But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane (CAS 84509-05-7) is a chemical compound with molecular formula C16H19NO7 and molecular weight 337.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
Also Known As: 5-(2-Methoxyphenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1), 6,8-Dioxa-3-azabicyclo(3.2.1)octane, 5-(2-methoxyphenyl)-, (Z)-2-butenedioate (1:1), but-2-enedioic acid; 1-(2-methoxyphenyl)-7,8-dioxa-3-azabicyclo[3.2.1]octane
| Molecular Formula | C16H19NO7 |
|---|---|
| Molecular Weight | 337.12 g/mol |
| LogP | 0.5784 |
| Topological Polar Surface Area | 114.32 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.11615 |
| Heavy Atoms | 24 |
| Complexity | 610.6069 |
Chemical Identifiers
| CAS Number | 84509-05-7 |
|---|---|
| SMILES | COC1=CC=CC=C1C23CNCC(O2)CO3.C(=CC(=O)O)C(=O)O |
Product Overview
But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane (CAS 84509-05-7), with molecular formula C16H19NO7 and molecular weight 337.12 g/mol. IUPAC: but-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane.
Chemical Property Profile of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
Property Insights of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
The XLogP value of 0.5784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane. The TPSA of 114.32 Ų falls within the moderate polarity range, balancing permeability and solubility for But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane. Following Lipinski's Rule of Five, But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane has 3 hydrogen bond donor(s) and 6 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 But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The CAS number of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is 84509-05-7.
What is the molecular formula of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The molecular formula of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is C16H19NO7.
What is the molecular weight of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The molecular weight of But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is 337.12 g/mol.
Where can I buy But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
You can request a quote for But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
Yes, KEHONG BIO provides custom synthesis services for But-2-enedioic acid;5-(2-methoxyphenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.