甲三甲酸
TL;DR: 甲三甲酸 (CAS 101687-15-4) is a chemical compound with molecular formula C4H4O6 and molecular weight 148.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲三甲酸
methanetricarboxylic acid
Also Known As: Methanetricarboxylic acid, 2-carboxyl malonic acid, methanetricarboxylicacid, J1.280.831C, RefChem:352476
| Molecular Formula | C4H4O6 |
|---|---|
| Molecular Weight | 148.00 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.0008 |
| Heavy Atoms | 10 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 101687-15-4 |
|---|---|
| SMILES | C(C(=O)O)(C(=O)O)C(=O)O |
| InChIKey | RKGQUTNLMXNUME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲三甲酸 (CAS 101687-15-4), with molecular formula C4H4O6 and molecular weight 148.00 g/mol. IUPAC: methanetricarboxylic acid.
Chemical Property Profile of 甲三甲酸
Property Insights of 甲三甲酸
The XLogP value of -0.7 indicates that 甲三甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 甲三甲酸. Following Lipinski's Rule of Five, 甲三甲酸 has 3 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 甲三甲酸?
The CAS number of 甲三甲酸 is 101687-15-4.
What is the molecular formula of 甲三甲酸?
The molecular formula of 甲三甲酸 is C4H4O6.
What is the molecular weight of 甲三甲酸?
The molecular weight of 甲三甲酸 is 148.00 g/mol.
Where can I buy 甲三甲酸?
You can request a quote for 甲三甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲三甲酸?
Yes, KEHONG BIO provides custom synthesis services for 甲三甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.