Diethylenetriamine
TL;DR: Diethylenetriamine (CAS 111-40-0) is a chemical compound with molecular formula C4H13N3 and molecular weight 103.11095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(2-aminoethyl)ethane-1,2-diamine
Also Known As: DIETHYLENETRIAMINE, Bis(2-aminoethyl)amine, Epicure T, Diethylene triamine, Ancamine DETA
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H13N3 |
| Molecular Weight | 103.11095 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 103.11095 Da |
| Heavy Atoms | 7 |
| Complexity | 26.0 |
| Melting Point | -38 °F (NTP, 1992) |
| Boiling Point | 405 °F at 760 mmHg (NTP, 1992) |
| Density | 0.954 at 68 °F (USCG, 1999) - Less dense than water; will float |
| Flash Point | 215 °F (NTP, 1992) |
| Vapor Pressure | 0.22 mmHg at 68 °F (NTP, 1992) |
| Refractive Index | INDEX OF REFRACTION: 1.4810 @ 25 °C/D |
| Solubility | Very soluble (NTP, 1992) |
| SMILES | C(CNCCN)N |
| InChIKey | RPNUMPOLZDHAAY-UHFFFAOYSA-N |
Product Description
Applications: Diethylenetriamine is used in polymer chemistry and functional materials synthesis, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Diethylenetriamine (CAS 111-40-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A polymer intermediate supplied by CoreyChem, Diethylenetriamine (CAS 111-40-0) has the molecular formula C4H13N3 and a molecular weight of 103.11 g/mol. Reported properties include a density of 0.954 at 68 °F (USCG, 1999) - Less dense than water; will float g/cm³, a solubility: Very soluble (NTP, 1992). It is also known as DIETHYLENETRIAMINE and Bis(2-aminoethyl)amine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Diethylenetriamine
Property Insights of Diethylenetriamine
The XLogP value of -2.1 indicates that Diethylenetriamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethylenetriamine. Following Lipinski's Rule of Five, Diethylenetriamine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethylenetriamine?
The CAS number of Diethylenetriamine is 111-40-0.
What is the molecular formula of Diethylenetriamine?
The molecular formula of Diethylenetriamine is C4H13N3.
What is the molecular weight of Diethylenetriamine?
The molecular weight of Diethylenetriamine is 103.11095 g/mol.
What are the applications of Diethylenetriamine?
Diethylenetriamine is used in polymer chemistry and functional materials synthesis, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Diethylenetriamine (CAS 111-40-0) with custom synthesis...
Where can I buy Diethylenetriamine?
You can request a quote for Diethylenetriamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethylenetriamine?
Yes, CoreyChem provides custom synthesis services for Diethylenetriamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.