Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride
TL;DR: Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride (CAS 21165-63-9) is a chemical compound with molecular formula C16H16ClF2N and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(3-fluorophenyl)prop-2-enyl-methylazanium chloride
Also Known As: ALLYLAMINE, 3,3-BIS(m-FLUOROPHENYL)-N-METHYL-, HYDROCHLORIDE, 3,3-bis(3-fluorophenyl)prop-2-enyl-methylazanium chloride, 3,3-Bis(m-fluorophenyl)-N-methylallylamine hydrochloride, Propene, 1,1-bis(m-fluorophenyl)-3-methylamino-, hydrochloride, 2-Propen-1-amine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride
| Molecular Formula | C16H16ClF2N |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | -0.41 |
| Topological Polar Surface Area | 16.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.09393 |
| Heavy Atoms | 20 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 21165-63-9 |
|---|---|
| SMILES | C[NH2+]CC=C(C1=CC(=CC=C1)F)C2=CC(=CC=C2)F.[Cl-] |
| InChIKey | LVQRQSCTKFPBSE-UHFFFAOYSA-N |
Product Overview
Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride (CAS 21165-63-9), with molecular formula C16H16ClF2N and molecular weight 295.09 g/mol. IUPAC: 3,3-bis(3-fluorophenyl)prop-2-enyl-methylazanium chloride.
Chemical Property Profile of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride
Property Insights of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride
The XLogP value of -0.41 indicates that Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.6 Ų, Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride has 1 hydrogen bond donor(s) and 3 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 Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride?
The CAS number of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride is 21165-63-9.
What is the molecular formula of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride?
The molecular formula of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride is C16H16ClF2N.
What is the molecular weight of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride?
The molecular weight of Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride is 295.09 g/mol.
Where can I buy Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride?
You can request a quote for Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Allylamine, 3,3-bis(m-fluorophenyl)-N-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.