3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride
TL;DR: 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride (CAS 284493-93-2) is a chemical compound with molecular formula C15H21BrClNO and molecular weight 345.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3-bromophenyl)-3-oxoprop-1-enyl]-triethylazanium chloride
Also Known As: [1,1-Biphenyl]-2,4-diol|3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride|[3-(3-bromophenyl)-3-oxoprop-1-enyl]-triethylazanium;chloride|[(E)-3-(3-bromophenyl)-3-oxoprop-1-enyl]-triethylazanium
| Molecular Formula | C15H21BrClNO |
|---|---|
| Molecular Weight | 345.05 g/mol |
| LogP | 1.026 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.0495 |
| Heavy Atoms | 19 |
| Complexity | 433.262 |
Chemical Identifiers
| CAS Number | 284493-93-2 |
|---|---|
| SMILES | CC[N+](CC)(CC)C=CC(=O)C1=CC(=CC=C1)Br.[Cl-] |
Product Overview
3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride (CAS 284493-93-2), with molecular formula C15H21BrClNO and molecular weight 345.05 g/mol. IUPAC: [3-(3-bromophenyl)-3-oxoprop-1-enyl]-triethylazanium chloride.
Chemical Property Profile of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride
Property Insights of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride
The XLogP value of 1.026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride. With a topological polar surface area (TPSA) of 17.07 Ų, 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium 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-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride?
The CAS number of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride is 284493-93-2.
What is the molecular formula of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride?
The molecular formula of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride is C15H21BrClNO.
What is the molecular weight of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride?
The molecular weight of 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride is 345.05 g/mol.
Where can I buy 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride?
You can request a quote for 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-bromophenyl)-N,N,N-triethyl-3-oxoprop-1-en-1-aminium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.