3-(羧甲基)戊二酸
TL;DR: 3-(羧甲基)戊二酸 (CAS 57056-39-0) is a chemical compound with molecular formula C7H10O6 and molecular weight 190.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(羧甲基)戊二酸
3-(carboxymethyl)pentanedioic acid
Also Known As: 3-(carboxymethyl)pentanedioic acid, methanetriacetic acid, Methantriessigsaure, 3- pentanedioicacid, Isobutantricarbonsaeure
| Molecular Formula | C7H10O6 |
|---|---|
| Molecular Weight | 190.05 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 190.04774 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 57056-39-0 |
|---|---|
| SMILES | C(C(CC(=O)O)CC(=O)O)C(=O)O |
| InChIKey | XYKQMCAWQYSNKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(羧甲基)戊二酸 (CAS 57056-39-0), with molecular formula C7H10O6 and molecular weight 190.05 g/mol. IUPAC: 3-(carboxymethyl)pentanedioic acid.
Chemical Property Profile of 3-(羧甲基)戊二酸
Property Insights of 3-(羧甲基)戊二酸
The XLogP value of -1.0 indicates that 3-(羧甲基)戊二酸 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 3-(羧甲基)戊二酸. Following Lipinski's Rule of Five, 3-(羧甲基)戊二酸 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 3-(羧甲基)戊二酸?
The CAS number of 3-(羧甲基)戊二酸 is 57056-39-0.
What is the molecular formula of 3-(羧甲基)戊二酸?
The molecular formula of 3-(羧甲基)戊二酸 is C7H10O6.
What is the molecular weight of 3-(羧甲基)戊二酸?
The molecular weight of 3-(羧甲基)戊二酸 is 190.05 g/mol.
Where can I buy 3-(羧甲基)戊二酸?
You can request a quote for 3-(羧甲基)戊二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(羧甲基)戊二酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(羧甲基)戊二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.