2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid
TL;DR: 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid (CAS 72912-01-7) is a chemical compound with molecular formula C16H30N2O8 and molecular weight 378.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[16-(carboxymethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetic acid
Also Known As: N,N'-DICARBOXYMETHYLDIAZA-18-CROWN-6, 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diacetic acid, 2,2'-(1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid, 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diaceticacid, 2-[16-(carboxymethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetic acid
| Molecular Formula | C16H30N2O8 |
|---|---|
| Molecular Weight | 378.20 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.20023 |
| Heavy Atoms | 26 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 72912-01-7 |
|---|---|
| SMILES | C1COCCOCCN(CCOCCOCCN1CC(=O)O)CC(=O)O |
| InChIKey | NCKZZTXKSYMGTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid (CAS 72912-01-7), with molecular formula C16H30N2O8 and molecular weight 378.20 g/mol. IUPAC: 2-[16-(carboxymethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetic acid.
Chemical Property Profile of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid
Property Insights of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid
The XLogP value of -5.9 indicates that 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid. Following Lipinski's Rule of Five, 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid has 2 hydrogen bond donor(s) and 10 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 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid?
The CAS number of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid is 72912-01-7.
What is the molecular formula of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid?
The molecular formula of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid is C16H30N2O8.
What is the molecular weight of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid?
The molecular weight of 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid is 378.20 g/mol.
Where can I buy 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid?
You can request a quote for 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.