4-Chloro-2-butenyltrimethylammonium chloride
TL;DR: 4-Chloro-2-butenyltrimethylammonium chloride (CAS 4237-07-4) is a chemical compound with molecular formula C7H15Cl2N and molecular weight 183.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chlorobut-2-enyl(trimethyl)azanium chloride
Also Known As: 4-chloro-2-butenyltrimethylammonium chloride, 4-Chloro-N,N,N-trimethylbut-2-en-1-aminium chloride, 2-Buten-1-aminium, 4-chloro-N,N,N-trimethyl-, chloride, 2-Buten-1-aminium, 4-chloro-N,N,N-trimethyl-, chloride (1:1)
| Molecular Formula | C7H15Cl2N |
|---|---|
| Molecular Weight | 183.06 g/mol |
| LogP | -1.51 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.05815 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 4237-07-4 |
|---|---|
| SMILES | C[N+](C)(C)CC=CCCl.[Cl-] |
| InChIKey | ZMSLJULQLLRFMB-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-butenyltrimethylammonium chloride (CAS 4237-07-4), with molecular formula C7H15Cl2N and molecular weight 183.06 g/mol. IUPAC: 4-chlorobut-2-enyl(trimethyl)azanium chloride.
Chemical Property Profile of 4-Chloro-2-butenyltrimethylammonium chloride
Property Insights of 4-Chloro-2-butenyltrimethylammonium chloride
The XLogP value of -1.51 indicates that 4-Chloro-2-butenyltrimethylammonium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Chloro-2-butenyltrimethylammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-butenyltrimethylammonium 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 4-Chloro-2-butenyltrimethylammonium chloride?
The CAS number of 4-Chloro-2-butenyltrimethylammonium chloride is 4237-07-4.
What is the molecular formula of 4-Chloro-2-butenyltrimethylammonium chloride?
The molecular formula of 4-Chloro-2-butenyltrimethylammonium chloride is C7H15Cl2N.
What is the molecular weight of 4-Chloro-2-butenyltrimethylammonium chloride?
The molecular weight of 4-Chloro-2-butenyltrimethylammonium chloride is 183.06 g/mol.
Where can I buy 4-Chloro-2-butenyltrimethylammonium chloride?
You can request a quote for 4-Chloro-2-butenyltrimethylammonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-butenyltrimethylammonium chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-butenyltrimethylammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.