3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-
TL;DR: 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- (CAS 71215-80-0) is a chemical compound with molecular formula C14H4Br4O4 and molecular weight 551.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8-tetrabromo-3,10-dioxatricyclo[10.2.2.04,9]hexadeca-1(15),4(9),5,7,12(16),13-hexaene-2,11-dione
Also Known As: 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-, 3,4,5,6-Tetrabromocatechol terephthalic acid cyclic ester, 9,10,11,12-Tetrabromo-3,6-etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-3,6-etheno-1,8-benzodioxecine-2,7-dione, 5,6,7,8-tetrabromo-3,10-dioxatricyclo[10.2.2.04,9]hexadeca-1(14),4,6,8,12,15-hexaene-2,11-dione
| Molecular Formula | C14H4Br4O4 |
|---|---|
| Molecular Weight | 551.68 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 555.68024 |
| Heavy Atoms | 22 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 71215-80-0 |
|---|---|
| SMILES | C1=CC2=CC=C1C(=O)OC3=C(C(=C(C(=C3Br)Br)Br)Br)OC2=O |
| InChIKey | YKUNDRZGOVMKHT-UHFFFAOYSA-N |
Product Overview
3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- (CAS 71215-80-0), with molecular formula C14H4Br4O4 and molecular weight 551.68 g/mol. IUPAC: 5,6,7,8-tetrabromo-3,10-dioxatricyclo[10.2.2.04,9]hexadeca-1(15),4(9),5,7,12(16),13-hexaene-2,11-dione.
Chemical Property Profile of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-
Property Insights of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-
The XLogP value of 5.5 indicates that 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-?
The CAS number of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- is 71215-80-0.
What is the molecular formula of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-?
The molecular formula of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- is C14H4Br4O4.
What is the molecular weight of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-?
The molecular weight of 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- is 551.68 g/mol.
Where can I buy 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-?
You can request a quote for 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo-?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Etheno-1,8-benzodioxecin-2,7-dione, 9,10,11,12-tetrabromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.