三仲丁基硼氢化锂
TL;DR: 三仲丁基硼氢化锂 (CAS 38721-52-7) is a chemical compound with molecular formula C44H88N2S4Zn and molecular weight 836.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三仲丁基硼氢化锂
zinc bis(N-octadecyl-N-propan-2-ylcarbamodithioate)
Also Known As: Zinc isopropyloctadecyldithiocarbamate, zinc bis[octadecyl(propan-2-yl)carbamodithioate], Bis(isopropyloctadecyldithiocarbamato-S,S')zinc, Bis[isopropyloctadecyldithiocarbamato-S,S']zinc, zinc N-octadecyl-N-propan-2-ylcarbamodithioate
| Molecular Formula | C44H88N2S4Zn |
|---|---|
| Molecular Weight | 836.51 g/mol |
| LogP | 15.5777 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 36 |
| Exact Mass | 836.5122 |
| Heavy Atoms | 51 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 38721-52-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCN(C(C)C)C(=S)[S-].CCCCCCCCCCCCCCCCCCN(C(C)C)C(=S)[S-].[Zn+2] |
| InChIKey | XIRMSEKPPCLFNS-UHFFFAOYSA-L |
Product Overview
三仲丁基硼氢化锂 (CAS 38721-52-7), with molecular formula C44H88N2S4Zn and molecular weight 836.51 g/mol. IUPAC: zinc bis(N-octadecyl-N-propan-2-ylcarbamodithioate).
Chemical Property Profile of 三仲丁基硼氢化锂
Property Insights of 三仲丁基硼氢化锂
The XLogP value of 15.5777 indicates that 三仲丁基硼氢化锂 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 三仲丁基硼氢化锂. Following Lipinski's Rule of Five, 三仲丁基硼氢化锂 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 三仲丁基硼氢化锂?
The CAS number of 三仲丁基硼氢化锂 is 38721-52-7.
What is the molecular formula of 三仲丁基硼氢化锂?
The molecular formula of 三仲丁基硼氢化锂 is C44H88N2S4Zn.
What is the molecular weight of 三仲丁基硼氢化锂?
The molecular weight of 三仲丁基硼氢化锂 is 836.51 g/mol.
Where can I buy 三仲丁基硼氢化锂?
You can request a quote for 三仲丁基硼氢化锂 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三仲丁基硼氢化锂?
Yes, KEHONG BIO provides custom synthesis services for 三仲丁基硼氢化锂 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.