2,2',3,3',5,5',6-Heptabromobiphenyl
TL;DR: 2,2',3,3',5,5',6-Heptabromobiphenyl (CAS 13950-56-6) is a chemical compound with molecular formula C12H3Br7 and molecular weight 699.45184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4,5-tetrabromo-3-(2,3,5-tribromophenyl)benzene
Also Known As: PBB 178, 2,2',3,3',5,5',6-heptabromobiphenyl, 1,2,4,5-tetrabromo-3-(2,3,5-tribromophenyl)benzene, 1,1'-Biphenyl,2,2',3,3',5,5',6-heptabromo-, 1,1'-Biphenyl, 2,2',3,3',5,5',6-heptabromo-
Technical Specifications
| Molecular Formula | C12H3Br7 |
| Molecular Weight | 699.45184 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 699.45184 Da |
| Heavy Atoms | 19 |
| Complexity | 298.0 |
| SMILES | C1=C(C=C(C(=C1C2=C(C(=CC(=C2Br)Br)Br)Br)Br)Br)Br |
| InChIKey | DIMYEFPFSWJMHA-UHFFFAOYSA-N |
Chemical Property Profile of 2,2',3,3',5,5',6-Heptabromobiphenyl
Property Insights of 2,2',3,3',5,5',6-Heptabromobiphenyl
The XLogP value of 8.4 indicates that 2,2',3,3',5,5',6-Heptabromobiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,2',3,3',5,5',6-Heptabromobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',3,3',5,5',6-Heptabromobiphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,2',3,3',5,5',6-Heptabromobiphenyl?
The CAS number of 2,2',3,3',5,5',6-Heptabromobiphenyl is 13950-56-6.
What is the molecular formula of 2,2',3,3',5,5',6-Heptabromobiphenyl?
The molecular formula of 2,2',3,3',5,5',6-Heptabromobiphenyl is C12H3Br7.
What is the molecular weight of 2,2',3,3',5,5',6-Heptabromobiphenyl?
The molecular weight of 2,2',3,3',5,5',6-Heptabromobiphenyl is 699.45184 g/mol.
Where can I buy 2,2',3,3',5,5',6-Heptabromobiphenyl?
You can request a quote for 2,2',3,3',5,5',6-Heptabromobiphenyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2',3,3',5,5',6-Heptabromobiphenyl?
Yes, CoreyChem provides custom synthesis services for 2,2',3,3',5,5',6-Heptabromobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.