Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride
TL;DR: Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride (CAS 107413-93-4) is a chemical compound with molecular formula C17H24Cl2N2O2 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl-[4-[3-[4-(methylazaniumyl)phenoxy]propoxy]phenyl]azanium dichloride
Also Known As: M & B 2519, ANILINE, 4,4'-(TRIMETHYLENEDIOXY)BIS(N-METHYL-, DIHYDROCHLORIDE, 4,4'-(Trimethylenedioxy)bis(N-methylaniline) dihydrochloride, methyl-[4-[3-[4-(methylazaniumyl)phenoxy]propoxy]phenyl]azanium;dichloride, Aniline,4,4'-(trimethylenedioxy)bis[N-methyl-, dihydrochloride (6CI)
| Molecular Formula | C17H24Cl2N2O2 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | -4.81 |
| Topological Polar Surface Area | 51.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.1215 |
| Heavy Atoms | 23 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 107413-93-4 |
|---|---|
| SMILES | C[NH2+]C1=CC=C(C=C1)OCCCOC2=CC=C(C=C2)[NH2+]C.[Cl-].[Cl-] |
| InChIKey | UTPSRCWJJARFMM-UHFFFAOYSA-N |
Product Overview
Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride (CAS 107413-93-4), with molecular formula C17H24Cl2N2O2 and molecular weight 358.12 g/mol. IUPAC: methyl-[4-[3-[4-(methylazaniumyl)phenoxy]propoxy]phenyl]azanium dichloride.
Chemical Property Profile of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride
Property Insights of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride
The XLogP value of -4.81 indicates that Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.7 Ų, Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride has 2 hydrogen bond donor(s) and 4 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 Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride?
The CAS number of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride is 107413-93-4.
What is the molecular formula of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride?
The molecular formula of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride is C17H24Cl2N2O2.
What is the molecular weight of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride?
The molecular weight of Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride is 358.12 g/mol.
Where can I buy Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride?
You can request a quote for Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Aniline, 4,4'-(trimethylenedioxy)bis(N-methyl-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.