N-(2-chloroethyl)propan-2-amine
TL;DR: N-(2-chloroethyl)propan-2-amine (CAS 6306-61-2) is a chemical compound with molecular formula C5H12ClN and molecular weight 121.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)propan-2-amine
Also Known As: N-(2-chloroethyl)propan-2-amine, (2-chloroethyl)(propan-2-yl)amine, Isopropyl(2-chloroethyl)amine, (2-chloro-ethyl)-isopropyl-amine, J2.898.409J
| Molecular Formula | C5H12ClN |
|---|---|
| Molecular Weight | 121.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.06583 |
| Heavy Atoms | 7 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 6306-61-2 |
|---|---|
| SMILES | CC(C)NCCCl |
| InChIKey | DEBOSDVZRKNQNU-UHFFFAOYSA-N |
Product Overview
N-(2-chloroethyl)propan-2-amine (CAS 6306-61-2), with molecular formula C5H12ClN and molecular weight 121.07 g/mol. IUPAC: N-(2-chloroethyl)propan-2-amine.
Chemical Property Profile of N-(2-chloroethyl)propan-2-amine
Property Insights of N-(2-chloroethyl)propan-2-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chloroethyl)propan-2-amine. With a topological polar surface area (TPSA) of 12.0 Ų, N-(2-chloroethyl)propan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chloroethyl)propan-2-amine has 1 hydrogen bond donor(s) and 1 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 N-(2-chloroethyl)propan-2-amine?
The CAS number of N-(2-chloroethyl)propan-2-amine is 6306-61-2.
What is the molecular formula of N-(2-chloroethyl)propan-2-amine?
The molecular formula of N-(2-chloroethyl)propan-2-amine is C5H12ClN.
What is the molecular weight of N-(2-chloroethyl)propan-2-amine?
The molecular weight of N-(2-chloroethyl)propan-2-amine is 121.07 g/mol.
Where can I buy N-(2-chloroethyl)propan-2-amine?
You can request a quote for N-(2-chloroethyl)propan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloroethyl)propan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloroethyl)propan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.