2-Chloropropyldimethylamine hydrochloride
TL;DR: 2-Chloropropyldimethylamine hydrochloride (CAS 4584-49-0) is a chemical compound with molecular formula C5H13Cl2N and molecular weight 157.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N,N-dimethylpropan-1-amine;hydrochloride
Also Known As: 2-chloro-N,N-dimethylpropan-1-amine hydrochloride, 2-Dimethylaminoisopropyl Chloride Hydrochloride, DMIC, 2-chloropropyldimethylamine hydrochloride, 2-Chloro-1-(dimethylamino)propane hydrochloride
| Molecular Formula | C5H13Cl2N |
|---|---|
| Molecular Weight | 157.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.04251 |
| Heavy Atoms | 8 |
| Complexity | 45.0 |
| Melting Point | 381 to 195.0 °C |
| Solubility | greater than or equal to 100 mg/mL at 70 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 4584-49-0 |
|---|---|
| SMILES | CC(CN(C)C)Cl.Cl |
| InChIKey | OCWGRWAYARCRTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloropropyldimethylamine hydrochloride (CAS 4584-49-0), with molecular formula C5H13Cl2N and molecular weight 157.04 g/mol. IUPAC: 2-chloro-N,N-dimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of 2-Chloropropyldimethylamine hydrochloride
Property Insights of 2-Chloropropyldimethylamine hydrochloride
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloropropyldimethylamine hydrochloride. With a topological polar surface area (TPSA) of 3.2 Ų, 2-Chloropropyldimethylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloropropyldimethylamine hydrochloride 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 2-Chloropropyldimethylamine hydrochloride?
The CAS number of 2-Chloropropyldimethylamine hydrochloride is 4584-49-0.
What is the molecular formula of 2-Chloropropyldimethylamine hydrochloride?
The molecular formula of 2-Chloropropyldimethylamine hydrochloride is C5H13Cl2N.
What is the molecular weight of 2-Chloropropyldimethylamine hydrochloride?
The molecular weight of 2-Chloropropyldimethylamine hydrochloride is 157.04 g/mol.
Where can I buy 2-Chloropropyldimethylamine hydrochloride?
You can request a quote for 2-Chloropropyldimethylamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloropropyldimethylamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloropropyldimethylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.