甲氧基乙酸
TL;DR: 甲氧基乙酸 (CAS 625-45-6) is a chemical compound with molecular formula C3H6O3 and molecular weight 90.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲氧基乙酸
2-methoxyacetic acid
Also Known As: 2-Methoxyacetic acid, METHOXYACETIC ACID, Acetic acid, methoxy-, Methoxyethanoic acid, methoxyacetate
| Molecular Formula | C3H6O3 |
|---|---|
| Molecular Weight | 90.03 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 90.03169 |
| Heavy Atoms | 6 |
| Complexity | 50.0 |
| Melting Point | 7.7 °C |
| Boiling Point | 397 to 203.9 °C at 760 mmHg |
| Density | 1.177 at 20.0 °C |
| Solubility | greater than or equal to 100 mg/mL at 66 °F (NTP, 1992) |
| Flash Point | greater than 112.8 °C |
| Vapor Pressure | 1 mmHg at 52.5 °C ; 40 mmHg at 122.2 °C; 400 mmHg at 184.2 °C |
Chemical Identifiers
| CAS Number | 625-45-6 |
|---|---|
| SMILES | COCC(=O)O |
| InChIKey | RMIODHQZRUFFFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲氧基乙酸 (CAS 625-45-6), with molecular formula C3H6O3 and molecular weight 90.03 g/mol. IUPAC: 2-methoxyacetic acid.
Chemical Property Profile of 甲氧基乙酸
Property Insights of 甲氧基乙酸
The XLogP value of -0.3 indicates that 甲氧基乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 甲氧基乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲氧基乙酸 has 1 hydrogen bond donor(s) and 3 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 甲氧基乙酸?
The CAS number of 甲氧基乙酸 is 625-45-6.
What is the molecular formula of 甲氧基乙酸?
The molecular formula of 甲氧基乙酸 is C3H6O3.
What is the molecular weight of 甲氧基乙酸?
The molecular weight of 甲氧基乙酸 is 90.03 g/mol.
Where can I buy 甲氧基乙酸?
You can request a quote for 甲氧基乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲氧基乙酸?
Yes, KEHONG BIO provides custom synthesis services for 甲氧基乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.