2-(Diisopropylamino)ethyl chloride
TL;DR: 2-(Diisopropylamino)ethyl chloride (CAS 96-79-7) is a chemical compound with molecular formula C8H18ClN and molecular weight 163.11278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-chloroethyl)-N-propan-2-ylpropan-2-amine
Also Known As: 2-(Diisopropylamino)ethyl chloride, 2-Chloro-N,N-diisopropylethylamine, N,N-Diisopropyl-2-chloroethylamine, 1-Chloro-2-diisopropylaminoethane, N-(2-Chloroethyl)diisopropylamine
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18ClN |
| Molecular Weight | 163.11278 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.11278 Da |
| Heavy Atoms | 10 |
| Complexity | 73.0 |
| SMILES | CC(C)N(CCCl)C(C)C |
| InChIKey | DBVADBHSJCWFKI-UHFFFAOYSA-N |
Product Description
Applications: 2-(Diisopropylamino)ethyl chloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-(Diisopropylamino)ethyl chloride is a pharmaceutical intermediate identified by CAS number 96-79-7 and the molecular formula C8H18ClN and a molecular weight of 163.11 g/mol. Synonyms include 2-(Diisopropylamino)ethyl chloride and 2-Chloro-N,N-diisopropylethylamine.
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 2-(Diisopropylamino)ethyl chloride
Property Insights of 2-(Diisopropylamino)ethyl chloride
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diisopropylamino)ethyl chloride. With a topological polar surface area (TPSA) of 3.2 Ų, 2-(Diisopropylamino)ethyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diisopropylamino)ethyl chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(Diisopropylamino)ethyl chloride?
The CAS number of 2-(Diisopropylamino)ethyl chloride is 96-79-7.
What is the molecular formula of 2-(Diisopropylamino)ethyl chloride?
The molecular formula of 2-(Diisopropylamino)ethyl chloride is C8H18ClN.
What is the molecular weight of 2-(Diisopropylamino)ethyl chloride?
The molecular weight of 2-(Diisopropylamino)ethyl chloride is 163.11278 g/mol.
What are the applications of 2-(Diisopropylamino)ethyl chloride?
2-(Diisopropylamino)ethyl chloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy 2-(Diisopropylamino)ethyl chloride?
You can request a quote for 2-(Diisopropylamino)ethyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Diisopropylamino)ethyl chloride?
Yes, CoreyChem provides custom synthesis services for 2-(Diisopropylamino)ethyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.