![but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate structure](/static/products/1257/125736-23-4.webp)
but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate
TL;DR: but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate (CAS 125736-23-4) is a chemical compound with molecular formula C14H19NO6 and molecular weight 297.12125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate
Also Known As: 9-Azabicyclo(4.2.1)non-2-ene-2-carboxylic acid, methyl ester, (1R)-, (E)-2-butenedioate (1:1), 9-Azabicyclo[4.2.1]non-2-ene-2-carboxylicacid, methyl ester, (1R)-, (2E)-2-butenedioate (1:1) (9CI)
Technical Specifications
| Molecular Formula | C14H19NO6 |
| Molecular Weight | 297.12125 g/mol |
| XLogP | 0.712 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.12125 Da |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
| SMILES | COC(=O)C1=CCCC2CC[C@H]1N2.C(=CC(=O)O)C(=O)O |
| InChIKey | VPVSNEXELLKXCB-LJGVWRNTSA-N |
Chemical Property Profile of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate
Property Insights of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate
The XLogP value of 0.712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate. Following Lipinski's Rule of Five, but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate?
The CAS number of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate is 125736-23-4.
What is the molecular formula of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate?
The molecular formula of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate is C14H19NO6.
What is the molecular weight of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate?
The molecular weight of but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate is 297.12125 g/mol.
Where can I buy but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate?
You can request a quote for but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for but-2-enedioic acid;methyl (1R)-9-azabicyclo[4.2.1]non-2-ene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.