Phaclofen
TL;DR: Phaclofen (CAS 114012-12-3) is a chemical compound with molecular formula C9H13ClNO3P and molecular weight 249.03217 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-amino-2-(4-chlorophenyl)propyl]phosphonic acid
Also Known As: Phaclofen, Phaclofen, solid, [3-amino-2-(4-chlorophenyl)propyl]phosphonic acid, Biomol-NT_000256, Lopac0_000967
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H13ClNO3P |
| Molecular Weight | 249.03217 g/mol |
| XLogP | -2.4 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.03217 Da |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
| SMILES | C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl |
| InChIKey | VSGNGLJPOGUDON-UHFFFAOYSA-N |
Product Description
Applications: Phaclofen is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. 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).
Phaclofen is a pharmaceutical intermediate identified by CAS number 114012-12-3 and the molecular formula C9H13ClNO3P and a molecular weight of 249.03 g/mol. Synonyms include Phaclofen and Phaclofen, solid.
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 Phaclofen
Property Insights of Phaclofen
The XLogP value of -2.4 indicates that Phaclofen is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phaclofen. Following Lipinski's Rule of Five, Phaclofen has 3 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 Phaclofen?
The CAS number of Phaclofen is 114012-12-3.
What is the molecular formula of Phaclofen?
The molecular formula of Phaclofen is C9H13ClNO3P.
What is the molecular weight of Phaclofen?
The molecular weight of Phaclofen is 249.03217 g/mol.
What are the applications of Phaclofen?
Phaclofen is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. 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...
Where can I buy Phaclofen?
You can request a quote for Phaclofen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phaclofen?
Yes, CoreyChem provides custom synthesis services for Phaclofen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.