![N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] structure](/static/products/813/81320-36-7.png)
N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]
TL;DR: N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] (CAS 81320-36-7) is a chemical compound with molecular formula C26H33NO9 and molecular weight 503.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6H-benzo[b][1,4]benzodioxepin-6-yl)-N,N-diethylpropan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French], 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, N,N-diethyl-, (+-)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--3-(11H-dibenzo[b,e][1,4]dioxepin-11-yl)-N,N-diethylpropan-1-amine (1/1), 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)-N,N-diethylpropan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid
| Molecular Formula | C26H33NO9 |
|---|---|
| Molecular Weight | 503.22 g/mol |
| LogP | 3.7859 |
| Topological Polar Surface Area | 153.83 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 503.21555 |
| Heavy Atoms | 36 |
| Complexity | 1019.57983 |
Chemical Identifiers
| CAS Number | 81320-36-7 |
|---|---|
| SMILES | CCN(CC)CCCC1C2=CC=CC=C2OC3=CC=CC=C3O1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] (CAS 81320-36-7), with molecular formula C26H33NO9 and molecular weight 503.22 g/mol. IUPAC: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)-N,N-diethylpropan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]
Property Insights of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]
The XLogP value of 3.7859 indicates that N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.83 Ų indicates high polarity, suggesting N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]?
The CAS number of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] is 81320-36-7.
What is the molecular formula of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]?
The molecular formula of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] is C26H33NO9.
What is the molecular weight of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]?
The molecular weight of N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] is 503.22 g/mol.
Where can I buy N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]?
You can request a quote for N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French]?
Yes, KEHONG BIO provides custom synthesis services for N-Diethyl 3-(dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine citrate [French] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.