Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
TL;DR: Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide (CAS 51226-53-0) is a chemical compound with molecular formula C15H14O3S and molecular weight 274.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R)-5-methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
Also Known As: Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide, (2S,5R)-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
| Molecular Formula | C15H14O3S |
|---|---|
| Molecular Weight | 274.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.06638 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 51226-53-0 |
|---|---|
| SMILES | C[C@@H]1C(OS(=O)O1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | ACONWRLGPDTDKX-ISGGMURCSA-N |
Product Overview
Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide (CAS 51226-53-0), with molecular formula C15H14O3S and molecular weight 274.07 g/mol. IUPAC: (5R)-5-methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide.
Chemical Property Profile of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
Property Insights of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide
The XLogP value of 3.4 indicates that Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide has 0 hydrogen bond donor(s) and 4 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 Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide?
The CAS number of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide is 51226-53-0.
What is the molecular formula of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide?
The molecular formula of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide is C15H14O3S.
What is the molecular weight of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide?
The molecular weight of Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide is 274.07 g/mol.
Where can I buy Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide?
You can request a quote for Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for Trans-5-Methyl-4,4-diphenyl-1,3,2-dioxathiolane 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.