![But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane structure](/static/products/845/84508-98-5.png)
But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
TL;DR: But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane (CAS 84508-98-5) is a chemical compound with molecular formula C15H16ClNO6 and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
Also Known As: 5-(3-Chlorophenyl)-6,8-dioxa-3-azabicyclo(3.2.1)octane (Z)-2-butenedioate (1:1), 6,8-Dioxa-3-azabicyclo(3.2.1)octane, 5-(3-chlorophenyl)-, (Z)-2-butenedioate (1:1)
| Molecular Formula | C15H16ClNO6 |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 1.2232 |
| Topological Polar Surface Area | 105.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.06662 |
| Heavy Atoms | 23 |
| Complexity | 599.7396 |
Chemical Identifiers
| CAS Number | 84508-98-5 |
|---|---|
| SMILES | C1C2COC(O2)(CN1)C3=CC(=CC=C3)Cl.C(=CC(=O)O)C(=O)O |
Product Overview
But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane (CAS 84508-98-5), with molecular formula C15H16ClNO6 and molecular weight 341.07 g/mol. IUPAC: but-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane.
Chemical Property Profile of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
Property Insights of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane
The XLogP value of 1.2232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane. The TPSA of 105.09 Ų falls within the moderate polarity range, balancing permeability and solubility for But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane. Following Lipinski's Rule of Five, But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane has 3 hydrogen bond donor(s) and 5 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-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The CAS number of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is 84508-98-5.
What is the molecular formula of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The molecular formula of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is C15H16ClNO6.
What is the molecular weight of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
The molecular weight of But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane is 341.07 g/mol.
Where can I buy But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
You can request a quote for But-2-enedioic acid;5-(3-chlorophenyl)-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-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane?
Yes, KEHONG BIO provides custom synthesis services for But-2-enedioic acid;5-(3-chlorophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.