2-氟丙二酸
TL;DR: 2-氟丙二酸 (CAS 473-87-0) is a chemical compound with molecular formula C3H3FO4 and molecular weight 122.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氟丙二酸
2-fluoropropanedioic acid
Also Known As: 2-fluoropropanedioic Acid, 2-fluoromalonic acid, fluoromalonic acid, Propanedioic acid, fluoro-, fluoropropanedioic acid
| Molecular Formula | C3H3FO4 |
|---|---|
| Molecular Weight | 122.00 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 122.00153 |
| Heavy Atoms | 8 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 473-87-0 |
|---|---|
| SMILES | C(C(=O)O)(C(=O)O)F |
| InChIKey | RBCXEDQEZDUMHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氟丙二酸 (CAS 473-87-0), with molecular formula C3H3FO4 and molecular weight 122.00 g/mol. IUPAC: 2-fluoropropanedioic acid.
Chemical Property Profile of 2-氟丙二酸
Property Insights of 2-氟丙二酸
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氟丙二酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氟丙二酸. Following Lipinski's Rule of Five, 2-氟丙二酸 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 2-氟丙二酸?
The CAS number of 2-氟丙二酸 is 473-87-0.
What is the molecular formula of 2-氟丙二酸?
The molecular formula of 2-氟丙二酸 is C3H3FO4.
What is the molecular weight of 2-氟丙二酸?
The molecular weight of 2-氟丙二酸 is 122.00 g/mol.
Where can I buy 2-氟丙二酸?
You can request a quote for 2-氟丙二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氟丙二酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氟丙二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.