1-Chloro-N,N-2-trimethylpropenylamine
TL;DR: 1-Chloro-N,N-2-trimethylpropenylamine (CAS 26189-59-3) is a chemical compound with molecular formula C6H12ClN and molecular weight 133.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-N,N,2-trimethylprop-1-en-1-amine
Also Known As: 1-Chloro-N,N,2-trimethylpropenylamine, Ghosez's reagent, Ghosezs reagent, 3-nitropropanal, Ghosez's reagent;
| Molecular Formula | C6H12ClN |
|---|---|
| Molecular Weight | 133.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.06583 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 26189-59-3 |
|---|---|
| SMILES | CC(=C(N(C)C)Cl)C |
| InChIKey | GQIRIWDEZSKOCN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-N,N-2-trimethylpropenylamine (CAS 26189-59-3), with molecular formula C6H12ClN and molecular weight 133.07 g/mol. IUPAC: 1-chloro-N,N,2-trimethylprop-1-en-1-amine.
Chemical Property Profile of 1-Chloro-N,N-2-trimethylpropenylamine
Property Insights of 1-Chloro-N,N-2-trimethylpropenylamine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-N,N-2-trimethylpropenylamine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Chloro-N,N-2-trimethylpropenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-N,N-2-trimethylpropenylamine 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 1-Chloro-N,N-2-trimethylpropenylamine?
The CAS number of 1-Chloro-N,N-2-trimethylpropenylamine is 26189-59-3.
What is the molecular formula of 1-Chloro-N,N-2-trimethylpropenylamine?
The molecular formula of 1-Chloro-N,N-2-trimethylpropenylamine is C6H12ClN.
What is the molecular weight of 1-Chloro-N,N-2-trimethylpropenylamine?
The molecular weight of 1-Chloro-N,N-2-trimethylpropenylamine is 133.07 g/mol.
Where can I buy 1-Chloro-N,N-2-trimethylpropenylamine?
You can request a quote for 1-Chloro-N,N-2-trimethylpropenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-N,N-2-trimethylpropenylamine?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-N,N-2-trimethylpropenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.