3,4-Difluoro-d-phenylalanine
TL;DR: 3,4-Difluoro-d-phenylalanine (CAS 31301-22-1) is a chemical compound with molecular formula C9H9F2NO2 and molecular weight 201.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-amino-3-(3,4-difluorophenyl)propanoic acid
Also Known As: 3,4-difluoro-d-phenylalanine, D-3,4-difluorophenylalanine, D-3,4-Difluorophe, H-D-Phe(3,4-DiF)-OH, (R)-2-Amino-3-(3,4-difluorophenyl)propanoic acid
| Molecular Formula | C9H9F2NO2 |
|---|---|
| Molecular Weight | 201.06 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.06013 |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 31301-22-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1C[C@H](C(=O)O)N)F)F |
| InChIKey | PRAWYXDDKCVZTL-MRVPVSSYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Difluoro-d-phenylalanine (CAS 31301-22-1), with molecular formula C9H9F2NO2 and molecular weight 201.06 g/mol. IUPAC: (2R)-2-amino-3-(3,4-difluorophenyl)propanoic acid.
Chemical Property Profile of 3,4-Difluoro-d-phenylalanine
Property Insights of 3,4-Difluoro-d-phenylalanine
The XLogP value of -1.8 indicates that 3,4-Difluoro-d-phenylalanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Difluoro-d-phenylalanine. Following Lipinski's Rule of Five, 3,4-Difluoro-d-phenylalanine has 2 hydrogen bond donor(s) and 5 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 3,4-Difluoro-d-phenylalanine?
The CAS number of 3,4-Difluoro-d-phenylalanine is 31301-22-1.
What is the molecular formula of 3,4-Difluoro-d-phenylalanine?
The molecular formula of 3,4-Difluoro-d-phenylalanine is C9H9F2NO2.
What is the molecular weight of 3,4-Difluoro-d-phenylalanine?
The molecular weight of 3,4-Difluoro-d-phenylalanine is 201.06 g/mol.
Where can I buy 3,4-Difluoro-d-phenylalanine?
You can request a quote for 3,4-Difluoro-d-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Difluoro-d-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Difluoro-d-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.