Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester
TL;DR: Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester (CAS 54473-70-0) is a chemical compound with molecular formula C16H24Br6O4 and molecular weight 753.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[3-bromo-2,2-bis(bromomethyl)propyl] hexanedioate
Also Known As: bis[3-bromo-2,2-bis(bromomethyl)propyl] adipate, bis[3-bromo-2,2-bis(bromomethyl)propyl] hexanedioate, Hexanedioic acid, bis(2,2,2-tris(bromomethyl)ethyl) ester, Hexanedioic acid, bis[3-bromo-2,2-bis(bromomethyl)propyl] ester, Hexanedioicacidbis[3-bromo-2,2-bis propyl]ester
| Molecular Formula | C16H24Br6O4 |
|---|---|
| Molecular Weight | 753.68 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 759.6713 |
| Heavy Atoms | 26 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 54473-70-0 |
|---|---|
| SMILES | C(CCC(=O)OCC(CBr)(CBr)CBr)CC(=O)OCC(CBr)(CBr)CBr |
| InChIKey | OGVCMSQSAJXIJQ-UHFFFAOYSA-N |
Product Overview
Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester (CAS 54473-70-0), with molecular formula C16H24Br6O4 and molecular weight 753.68 g/mol. IUPAC: bis[3-bromo-2,2-bis(bromomethyl)propyl] hexanedioate.
Chemical Property Profile of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester
Property Insights of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester
The XLogP value of 5.4 indicates that Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester 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 Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester?
The CAS number of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester is 54473-70-0.
What is the molecular formula of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester?
The molecular formula of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester is C16H24Br6O4.
What is the molecular weight of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester?
The molecular weight of Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester is 753.68 g/mol.
Where can I buy Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester?
You can request a quote for Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Hexanedioic acid, 1,6-bis(3-bromo-2,2-bis(bromomethyl)propyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.