3-Chloro-2-methylpropyl(dimethyl)ammonium chloride
TL;DR: 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride (CAS 1329614-05-2) is a chemical compound with molecular formula C6H15Cl2N and molecular weight 171.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N,N,2-trimethylpropan-1-amine;hydrochloride
Also Known As: 3-Dimethylamino-2-methylpropyl chloride hydrochloride, 3-chloro-N,N,2-trimethylpropan-1-amine hydrochloride, EINECS 224-237-6, 3-chloro-N,N,2-trimethylpropan-1-amine;hydrochloride, 2-bromo-1,3-diphenyl-3-propanedione
| Molecular Formula | C6H15Cl2N |
|---|---|
| Molecular Weight | 171.06 g/mol |
| LogP | 1.8447 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.05815 |
| Heavy Atoms | 9 |
| Complexity | 57.01955 |
Chemical Identifiers
| CAS Number | 1329614-05-2 |
|---|---|
| SMILES | CC(CN(C)C)CCl.Cl |
Product Overview
3-Chloro-2-methylpropyl(dimethyl)ammonium chloride (CAS 1329614-05-2), with molecular formula C6H15Cl2N and molecular weight 171.06 g/mol. IUPAC: 3-chloro-N,N,2-trimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride
Property Insights of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride
The XLogP value of 1.8447 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride. With a topological polar surface area (TPSA) of 3.24 Ų, 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2-methylpropyl(dimethyl)ammonium 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
Frequently Asked Questions
What is the CAS number of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride?
The CAS number of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride is 1329614-05-2.
What is the molecular formula of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride?
The molecular formula of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride is C6H15Cl2N.
What is the molecular weight of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride?
The molecular weight of 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride is 171.06 g/mol.
Where can I buy 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride?
You can request a quote for 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2-methylpropyl(dimethyl)ammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.