![双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 structure](/static/products/9900/99004-00-9.webp)
双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺
TL;DR: 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 (CAS 99004-00-9) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺
2-(1,3-benzodioxol-5-yl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]ethanamine
Also Known As: Dopamine Impurity 4, Bis[2-(1,3-benzodioxole-5-yl)ethyl]amine, J1.447.663F, bis[2-(2H-1,3-benzodioxol-5-yl)ethyl]amine, Bis(2-(benzo[d][1,3]dioxol-5-yl)ethyl)amine
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 99004-00-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CCNCCC3=CC4=C(C=C3)OCO4 |
| InChIKey | YRROTAXHOMYTBA-UHFFFAOYSA-N |
Product Overview
双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 (CAS 99004-00-9), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]ethanamine.
Chemical Property Profile of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺
Property Insights of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺
The XLogP value of 3.3 indicates that 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.0 Ų, 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 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 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺?
The CAS number of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 is 99004-00-9.
What is the molecular formula of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺?
The molecular formula of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 is C18H19NO4.
What is the molecular weight of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺?
The molecular weight of 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 is 313.13 g/mol.
Where can I buy 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺?
You can request a quote for 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺?
Yes, KEHONG BIO provides custom synthesis services for 双(2-(苯并[d][1,3]二氧戊环-5-基)乙基)胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.