3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride
TL;DR: 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride (CAS 892-53-5) is a chemical compound with molecular formula C18H22ClN and molecular weight 287.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-diphenylbut-3-enyl(dimethyl)azanium chloride
Also Known As: N,N-Dimethyl-4,4-diphenyl-3-butenylamine hydrochloride, 3-BUTENYLAMINE, N,N-DIMETHYL-4,4-DIPHENYL-, HYDROCHLORIDE, 4,4-diphenylbut-3-enyl(dimethyl)azanium chloride, RefChem:1067492
| Molecular Formula | C18H22ClN |
|---|---|
| Molecular Weight | 287.14 g/mol |
| LogP | -0.34 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.14407 |
| Heavy Atoms | 20 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 892-53-5 |
|---|---|
| SMILES | C[NH+](C)CCC=C(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | WFWARGVWOBVRBH-UHFFFAOYSA-N |
Product Overview
3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride (CAS 892-53-5), with molecular formula C18H22ClN and molecular weight 287.14 g/mol. IUPAC: 4,4-diphenylbut-3-enyl(dimethyl)azanium chloride.
Chemical Property Profile of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride
Property Insights of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride
The XLogP value of -0.34 indicates that 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride has 1 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-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride?
The CAS number of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride is 892-53-5.
What is the molecular formula of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride?
The molecular formula of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride is C18H22ClN.
What is the molecular weight of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride?
The molecular weight of 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride is 287.14 g/mol.
Where can I buy 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride?
You can request a quote for 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Butenylamine, N,N-dimethyl-4,4-diphenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.