alpha-Monofluoromethyldopa
TL;DR: alpha-Monofluoromethyldopa (CAS 69938-07-4) is a chemical compound with molecular formula C10H12FNO4 and molecular weight 229.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-2-[(3,4-dihydroxyphenyl)methyl]-3-fluoropropanoic acid
Also Known As: Monofluoromethyl-dopa, alpha-Fluoromethyldopa, MFMD, alpha-monofluoromethyldopa, Rmi 71963
| Molecular Formula | C10H12FNO4 |
|---|---|
| Molecular Weight | 229.08 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.07504 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 69938-07-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1C[C@@](CF)(C(=O)O)N)O)O |
| InChIKey | NRNSHPCDKHOUOE-SNVBAGLBSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Monofluoromethyldopa (CAS 69938-07-4), with molecular formula C10H12FNO4 and molecular weight 229.08 g/mol. IUPAC: (2S)-2-amino-2-[(3,4-dihydroxyphenyl)methyl]-3-fluoropropanoic acid.
Chemical Property Profile of alpha-Monofluoromethyldopa
Property Insights of alpha-Monofluoromethyldopa
The XLogP value of -2.0 indicates that alpha-Monofluoromethyldopa is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Monofluoromethyldopa. Following Lipinski's Rule of Five, alpha-Monofluoromethyldopa has 4 hydrogen bond donor(s) and 6 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 alpha-Monofluoromethyldopa?
The CAS number of alpha-Monofluoromethyldopa is 69938-07-4.
What is the molecular formula of alpha-Monofluoromethyldopa?
The molecular formula of alpha-Monofluoromethyldopa is C10H12FNO4.
What is the molecular weight of alpha-Monofluoromethyldopa?
The molecular weight of alpha-Monofluoromethyldopa is 229.08 g/mol.
Where can I buy alpha-Monofluoromethyldopa?
You can request a quote for alpha-Monofluoromethyldopa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Monofluoromethyldopa?
Yes, KEHONG BIO provides custom synthesis services for alpha-Monofluoromethyldopa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.