5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate
TL;DR: 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate (CAS 154229-19-3) is a chemical compound with molecular formula C15H10NO3- and molecular weight 252.06607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate
Also Known As: Abiraterone, FUREGRELATE SODIUM, 5-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate, 5-(pyridin-3-ylmethyl)benzofuran-2-carboxylate, (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Technical Specifications
| Molecular Formula | C15H10NO3- |
| Molecular Weight | 252.06607 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 66.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.06607 Da |
| Heavy Atoms | 19 |
| Complexity | 328.0 |
| SMILES | C1=CC(=CN=C1)CC2=CC3=C(C=C2)OC(=C3)C(=O)[O-] |
| InChIKey | VHWFITPGPFLBGT-UHFFFAOYSA-M |
Product Description
Applications: 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate (CAS 154229-19-3) is a fine chemical with the molecular formula C15H10NO3- and a molecular weight of 252.07 g/mol. Synonyms include Abiraterone and FUREGRELATE SODIUM.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate
Property Insights of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate
The XLogP value of 3.7 indicates that 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate. Following Lipinski's Rule of Five, 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
The CAS number of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is 154229-19-3.
What is the molecular formula of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
The molecular formula of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is C15H10NO3-.
What is the molecular weight of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
The molecular weight of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is 252.06607 g/mol.
What are the applications of 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
You can request a quote for 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for 5-(Pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.