1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane
TL;DR: 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane (CAS 546-44-1) is a chemical compound with molecular formula C13H26O2Si3 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxysilane
Also Known As: 2-Hexadecanol, 3-PHENYLHEPTAMETHYLTRISILOXANE, 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane, Methylphenylbis(trimethylsiloxy)silane, trimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxysilane
| Molecular Formula | C13H26O2Si3 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 3.6686 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.12405 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 546-44-1 |
|---|---|
| SMILES | C[Si](C)(C)O[Si](C)(C1=CC=CC=C1)O[Si](C)(C)C |
| InChIKey | FNATTZRLLOIKNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane (CAS 546-44-1), with molecular formula C13H26O2Si3 and molecular weight 298.12 g/mol. IUPAC: trimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxysilane.
Chemical Property Profile of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane
Property Insights of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane
The XLogP value of 3.6686 indicates that 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane has 0 hydrogen bond donor(s) and 2 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 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane?
The CAS number of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane is 546-44-1.
What is the molecular formula of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane?
The molecular formula of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane is C13H26O2Si3.
What is the molecular weight of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane?
The molecular weight of 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane is 298.12 g/mol.
Where can I buy 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane?
You can request a quote for 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.