法氯芬
TL;DR: 法氯芬 (CAS 114012-12-3) is a chemical compound with molecular formula C9H13ClNO3P and molecular weight 249.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
法氯芬
[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
| Molecular Formula | C9H13ClNO3P |
|---|---|
| Molecular Weight | 249.03 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.03217 |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 114012-12-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl |
| InChIKey | VSGNGLJPOGUDON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
法氯芬 (CAS 114012-12-3), with molecular formula C9H13ClNO3P and molecular weight 249.03 g/mol. IUPAC: [3-amino-2-(4-chlorophenyl)propyl]phosphonic acid.
Chemical Property Profile of 法氯芬
Property Insights of 法氯芬
The XLogP value of -2.4 indicates that 法氯芬 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 法氯芬. Following Lipinski's Rule of Five, 法氯芬 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
Frequently Asked Questions
What is the CAS number of 法氯芬?
The CAS number of 法氯芬 is 114012-12-3.
What is the molecular formula of 法氯芬?
The molecular formula of 法氯芬 is C9H13ClNO3P.
What is the molecular weight of 法氯芬?
The molecular weight of 法氯芬 is 249.03 g/mol.
Where can I buy 法氯芬?
You can request a quote for 法氯芬 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 法氯芬?
Yes, KEHONG BIO provides custom synthesis services for 法氯芬 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.