![but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate structure](/static/products/1551/155156-22-2.webp)
but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
TL;DR: but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate (CAS 155156-22-2) is a chemical compound with molecular formula C22H28ClNO7 and molecular weight 453.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
Also Known As: Butanoic acid, 2-(4-chlorophenoxy)-, endo-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (2R)-, (2Z)-2-butenedioate (1:1) (9CI)
| Molecular Formula | C22H28ClNO7 |
|---|---|
| Molecular Weight | 453.16 g/mol |
| LogP | 3.3776 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.15543 |
| Heavy Atoms | 31 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 155156-22-2 |
|---|---|
| SMILES | CC[C@H](C(=O)OC1CC2CCC(C1)N2C)OC3=CC=C(C=C3)Cl.C(=CC(=O)O)C(=O)O |
| InChIKey | BHXGTFUQDGMXHA-BKRDNXHLSA-N |
Product Overview
but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate (CAS 155156-22-2), with molecular formula C22H28ClNO7 and molecular weight 453.16 g/mol. IUPAC: but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate.
Chemical Property Profile of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
Property Insights of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
The XLogP value of 3.3776 indicates that but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate. Following Lipinski's Rule of Five, but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate has 2 hydrogen bond donor(s) and 8 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;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate?
The CAS number of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate is 155156-22-2.
What is the molecular formula of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate?
The molecular formula of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate is C22H28ClNO7.
What is the molecular weight of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate?
The molecular weight of but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate is 453.16 g/mol.
Where can I buy but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate?
You can request a quote for but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate 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;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate?
Yes, KEHONG BIO provides custom synthesis services for but-2-enedioic acid;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.