1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
TL;DR: 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- (CAS 112400-67-6) is a chemical compound with molecular formula C9H19BSSi and molecular weight 198.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diethyl-2,2,3-trimethyl-1,2,5-thiasilaborole
Also Known As: 4,5-diethyl-2,2,3-trimethyl-1,2,5-thiasilaborole, 4,5-Diethyl-2,2,3-trimethyl-2,5-dihydro-1,2,5-thiasilaborole, 4,5-Diethyl-2,2,3-trimethyl-2,5-dihydro-1,2,5-thiasilaborole #, 4,5-diethyl-2,5-dihydro-2,2,3-trimethyl-1,2,5-thiasilaborole, 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
| Molecular Formula | C9H19BSSi |
|---|---|
| Molecular Weight | 198.11 g/mol |
| LogP | 3.7546 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.10698 |
| Heavy Atoms | 12 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 112400-67-6 |
|---|---|
| SMILES | B1(C(=C([Si](S1)(C)C)C)CC)CC |
| InChIKey | QFZLQLYFAVSHMX-UHFFFAOYSA-N |
Product Overview
1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- (CAS 112400-67-6), with molecular formula C9H19BSSi and molecular weight 198.11 g/mol. IUPAC: 4,5-diethyl-2,2,3-trimethyl-1,2,5-thiasilaborole.
Chemical Property Profile of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
Property Insights of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
The XLogP value of 3.7546 indicates that 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-?
The CAS number of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- is 112400-67-6.
What is the molecular formula of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-?
The molecular formula of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- is C9H19BSSi.
What is the molecular weight of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-?
The molecular weight of 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- is 198.11 g/mol.
Where can I buy 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-?
You can request a quote for 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Thia-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.