11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-
TL;DR: 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- (CAS 81320-32-3) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.13 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)propan-1-amine
Also Known As: (+-)-11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (Dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine, (Dibenzo(b,e) 1,4-dioxepin-11-yl)propylamine [French], 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-, 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine
| Molecular Formula | C16H17NO2 |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 3.6513 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.12593 |
| Heavy Atoms | 19 |
| Complexity | 568.1803 |
Chemical Identifiers
| CAS Number | 81320-32-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(OC3=CC=CC=C3O2)CCCN |
Product Overview
11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- (CAS 81320-32-3), with molecular formula C16H17NO2 and molecular weight 255.13 g/mol. IUPAC: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine.
Chemical Property Profile of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-
Property Insights of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-
The XLogP value of 3.6513 indicates that 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.48 Ų, 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- 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 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-?
The CAS number of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- is 81320-32-3.
What is the molecular formula of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-?
The molecular formula of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- is C16H17NO2.
What is the molecular weight of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-?
The molecular weight of 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- is 255.13 g/mol.
Where can I buy 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-?
You can request a quote for 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 11H-Dibenzo(b,e)(1,4)dioxepin-11-propanamine, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.