DTPA Impurity 1
TL;DR: DTPA Impurity 1 (CAS 27825-74-7) is a chemical compound with molecular formula C14H18N8 and molecular weight 298.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis[2-[bis(cyanomethyl)amino]ethyl]amino]acetonitrile
Also Known As: DTPA Impurity 1, 2-[bis[2-[bis(cyanomethyl)amino]ethyl]amino]acetonitrile, Acetonitrile, 2,2',2'',2'''-[[(cyanomethyl)imino]bis(2,1-ethanediylnitrilo)]tetrakis-, 2,2',2'',2''',2''''-(Ethane-1,2-diylnitrilo)pentaacetonitrile, 2-[2-[2-(bis(cyanomethyl)amino)ethyl-(cyanomethyl)amino]ethyl-(cyanomethyl)amino]acetonitrile
| Molecular Formula | C14H18N8 |
|---|---|
| Molecular Weight | 298.17 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 298.16544 |
| Heavy Atoms | 22 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 27825-74-7 |
|---|---|
| SMILES | C(CN(CC#N)CC#N)N(CCN(CC#N)CC#N)CC#N |
| InChIKey | PLIYQKRDYBEHIZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DTPA Impurity 1 (CAS 27825-74-7), with molecular formula C14H18N8 and molecular weight 298.17 g/mol. IUPAC: 2-[bis[2-[bis(cyanomethyl)amino]ethyl]amino]acetonitrile.
Chemical Property Profile of DTPA Impurity 1
Property Insights of DTPA Impurity 1
The XLogP value of -0.7 indicates that DTPA Impurity 1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DTPA Impurity 1. Following Lipinski's Rule of Five, DTPA Impurity 1 has 0 hydrogen bond donor(s) and 8 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 DTPA Impurity 1?
The CAS number of DTPA Impurity 1 is 27825-74-7.
What is the molecular formula of DTPA Impurity 1?
The molecular formula of DTPA Impurity 1 is C14H18N8.
What is the molecular weight of DTPA Impurity 1?
The molecular weight of DTPA Impurity 1 is 298.17 g/mol.
Where can I buy DTPA Impurity 1?
You can request a quote for DTPA Impurity 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DTPA Impurity 1?
Yes, KEHONG BIO provides custom synthesis services for DTPA Impurity 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.