Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride
TL;DR: Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride (CAS 1676-52-4) is a chemical compound with molecular formula C18H20ClNO4 and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(1,3-benzodioxol-5-yl)ethyl]azanium chloride
Also Known As: 3,3',4,4'-Bis(methylenedioxy)diphenethylamine hydrochloride, bis[2-(1,3-benzodioxol-5-yl)ethyl]azanium chloride, DIPHENETHYLAMINE, 3,3',4,4'-BIS(METHYLENEDIOXY)-, HYDROCHLORIDE, 1,3-Benzodioxole-5-ethanamine, N-[2-(1,3-benzodioxol-5-yl)ethyl]-, hydrochloride, RefChem:338902
| Molecular Formula | C18H20ClNO4 |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.1081 |
| Heavy Atoms | 24 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 1676-52-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CC[NH2+]CCC3=CC4=C(C=C3)OCO4.[Cl-] |
| InChIKey | VECLFJFBQNVRJL-UHFFFAOYSA-N |
Product Overview
Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride (CAS 1676-52-4), with molecular formula C18H20ClNO4 and molecular weight 349.11 g/mol. IUPAC: bis[2-(1,3-benzodioxol-5-yl)ethyl]azanium chloride.
Chemical Property Profile of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride
Property Insights of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride
The XLogP value of -1.5 indicates that Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.5 Ų, Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride has 1 hydrogen bond donor(s) and 5 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 Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride?
The CAS number of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride is 1676-52-4.
What is the molecular formula of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride?
The molecular formula of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride is C18H20ClNO4.
What is the molecular weight of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride?
The molecular weight of Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride is 349.11 g/mol.
Where can I buy Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride?
You can request a quote for Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Diphenethylamine, 3,3',4,4'-bis(methylenedioxy)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.