Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester
TL;DR: Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester (CAS 73758-19-7) is a chemical compound with molecular formula C12H18BCl9O3 and molecular weight 535.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(1,1,1-trichloro-2-methylpropan-2-yl) borate
Also Known As: Tris(beta,beta,beta-trichloro-t-butyl)borate, Tris(2,2,2-trichloro-1,1-dimethylethyl)borate, tris(1,1,1-trichloro-2-methylpropan-2-yl) borate, 4-01-00-01632 (Beilstein Handbook Reference), BORIC ACID, TRIS(2,2,2-TRICHLORO-1,1-DIMETHYLETHYL) ESTER
| Molecular Formula | C12H18BCl9O3 |
|---|---|
| Molecular Weight | 535.85 g/mol |
| LogP | 7.47 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.8487 |
| Heavy Atoms | 25 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 73758-19-7 |
|---|---|
| SMILES | B(OC(C)(C)C(Cl)(Cl)Cl)(OC(C)(C)C(Cl)(Cl)Cl)OC(C)(C)C(Cl)(Cl)Cl |
| InChIKey | ZMRDGILYNGFIQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester (CAS 73758-19-7), with molecular formula C12H18BCl9O3 and molecular weight 535.85 g/mol. IUPAC: tris(1,1,1-trichloro-2-methylpropan-2-yl) borate.
Chemical Property Profile of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester
Property Insights of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester
The XLogP value of 7.47 indicates that Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester?
The CAS number of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester is 73758-19-7.
What is the molecular formula of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester?
The molecular formula of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester is C12H18BCl9O3.
What is the molecular weight of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester?
The molecular weight of Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester is 535.85 g/mol.
Where can I buy Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester?
You can request a quote for Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Boric acid, tris(2,2,2-trichloro-1,1-dimethylethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.