Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-
TL;DR: Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- (CAS 117549-94-7) is a chemical compound with molecular formula C12Br3Cl5O2 and molecular weight 587.5891 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3-tribromo-4,6,7,8,9-pentachlorodibenzo-p-dioxin
Also Known As: KST-1B0001, 1,2,3-tribromo-4,6,7,8,9-pentachlorooxanthrene, Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-, Dibenzo[b,e][1,4]dioxin,tribromopentachloro- (9CI), 1,2,3-tribromo-4,6,7,8,9-pentachlorodibenzo-p-dioxin
Technical Specifications
| Molecular Formula | C12Br3Cl5O2 |
| Molecular Weight | 587.5891 g/mol |
| XLogP | 8.3 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 587.5891 Da |
| Heavy Atoms | 22 |
| Complexity | 436.0 |
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C(O2)C(=C(C(=C3Br)Br)Br)Cl |
| InChIKey | IBGGMNOUXCEPBQ-UHFFFAOYSA-N |
Chemical Property Profile of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-
Property Insights of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-
The XLogP value of 8.3 indicates that Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-?
The CAS number of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- is 117549-94-7.
What is the molecular formula of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-?
The molecular formula of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- is C12Br3Cl5O2.
What is the molecular weight of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-?
The molecular weight of Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- is 587.5891 g/mol.
Where can I buy Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-?
You can request a quote for Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenzo(b,e)(1,4)dioxin, tribromopentachloro-?
Yes, CoreyChem provides custom synthesis services for Dibenzo(b,e)(1,4)dioxin, tribromopentachloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.