RefChem:574396
TL;DR: RefChem:574396 (CAS 71216-03-0) is a chemical compound with molecular formula C29H10Br14O6 and molecular weight 1558.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,6-dibromo-4-[2-[3,5-dibromo-4-(2,3,4,5,6-pentabromophenoxy)carbonyloxyphenyl]propan-2-yl]phenyl] (2,3,4,5,6-pentabromophenyl) carbonate
Also Known As: 1,1'- bis bis[ oxy]bis, Carbonic acid, (1-methylethylidene)bis(2,6-dibromo-4,1-phenylene) bis(pentabromophenyl) ester, Carbonic acid, C,C'-((1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)) C,C'-bis(2,3,4,5,6-pentabromophenyl) ester, bis(pentabromophenyl) propane-2,2-diylbis-2,6-dibromobenzene-4,1-diyl biscarbonate, Bis(pentabromophenyl) (propane-2,2-diyl)bis(2,6-dibromo-4,1-phenylene) biscarbonate
| Molecular Formula | C29H10Br14O6 |
|---|---|
| Molecular Weight | 1558.90 g/mol |
| LogP | 17.8 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 1572.8901 |
| Heavy Atoms | 49 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 71216-03-0 |
|---|---|
| SMILES | CC(C)(C1=CC(=C(C(=C1)Br)OC(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br)C3=CC(=C(C(=C3)Br)OC(=O)OC4=C(C(=C(C(=C4Br)Br)Br)Br)Br)Br |
| InChIKey | NUMCIRUBNXCHTA-UHFFFAOYSA-N |
Product Overview
RefChem:574396 (CAS 71216-03-0), with molecular formula C29H10Br14O6 and molecular weight 1558.90 g/mol. IUPAC: [2,6-dibromo-4-[2-[3,5-dibromo-4-(2,3,4,5,6-pentabromophenoxy)carbonyloxyphenyl]propan-2-yl]phenyl] (2,3,4,5,6-pentabromophenyl) carbonate.
Chemical Property Profile of RefChem:574396
Property Insights of RefChem:574396
The XLogP value of 17.8 indicates that RefChem:574396 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:574396. Following Lipinski's Rule of Five, RefChem:574396 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:574396?
The CAS number of RefChem:574396 is 71216-03-0.
What is the molecular formula of RefChem:574396?
The molecular formula of RefChem:574396 is C29H10Br14O6.
What is the molecular weight of RefChem:574396?
The molecular weight of RefChem:574396 is 1558.90 g/mol.
Where can I buy RefChem:574396?
You can request a quote for RefChem:574396 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:574396?
Yes, KEHONG BIO provides custom synthesis services for RefChem:574396 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.