2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid
TL;DR: 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid (CAS 401-48-9) is a chemical compound with molecular formula C4H6FN3O3 and molecular weight 163.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(carbamoylhydrazinylidene)-3-fluoropropanoic acid
Also Known As: NCIOpen2_001433, 3-fluoro-2-semicarbazono-propionic acid, 3-Fluor-2-O-hecadecyl-propan-1,2-diol, 2-(carbamoylhydrazinylidene)-3-fluoropropanoic acid, Propanoic acid, 2-[2-(aminocarbonyl)hydrazinylidene]-3-fluoro-
| Molecular Formula | C4H6FN3O3 |
|---|---|
| Molecular Weight | 163.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.03932 |
| Heavy Atoms | 11 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 401-48-9 |
|---|---|
| SMILES | C(C(=NNC(=O)N)C(=O)O)F |
| InChIKey | OZFWGLKSYBUKQQ-UHFFFAOYSA-N |
Product Overview
2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid (CAS 401-48-9), with molecular formula C4H6FN3O3 and molecular weight 163.04 g/mol. IUPAC: 2-(carbamoylhydrazinylidene)-3-fluoropropanoic acid.
Chemical Property Profile of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid
Property Insights of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid
The XLogP value of -0.2 indicates that 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid. Following Lipinski's Rule of Five, 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid has 3 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 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid?
The CAS number of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid is 401-48-9.
What is the molecular formula of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid?
The molecular formula of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid is C4H6FN3O3.
What is the molecular weight of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid?
The molecular weight of 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid is 163.04 g/mol.
Where can I buy 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid?
You can request a quote for 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Carbamoylhydrazinylidene)-3-fluoropropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.