m-Dioxane, 5-methyl-4-phenyl-, cis-
TL;DR: m-Dioxane, 5-methyl-4-phenyl-, cis- (CAS 2033-27-4) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,5S)-5-methyl-4-phenyl-1,3-dioxane
Also Known As: m-Dioxane, 5-methyl-4-phenyl-, cis-, (4R,5S)-5-methyl-4-phenyl-1,3-dioxane, 1,3-Dioxane, 5-methyl-4-phenyl-, cis-, (4S,5R)-5-methyl-4-phenyl-1,3-dioxane, 1,3-Dioxane, 5-methyl-4-phenyl-, (4R,5S)-rel-
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 2033-27-4 |
|---|---|
| SMILES | C[C@H]1COCO[C@H]1C2=CC=CC=C2 |
| InChIKey | KNYICOMGRQTGKP-GXSJLCMTSA-N |
Product Overview
m-Dioxane, 5-methyl-4-phenyl-, cis- (CAS 2033-27-4), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: (4R,5S)-5-methyl-4-phenyl-1,3-dioxane.
Chemical Property Profile of m-Dioxane, 5-methyl-4-phenyl-, cis-
Property Insights of m-Dioxane, 5-methyl-4-phenyl-, cis-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Dioxane, 5-methyl-4-phenyl-, cis-. With a topological polar surface area (TPSA) of 18.5 Ų, m-Dioxane, 5-methyl-4-phenyl-, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-Dioxane, 5-methyl-4-phenyl-, cis- 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 m-Dioxane, 5-methyl-4-phenyl-, cis-?
The CAS number of m-Dioxane, 5-methyl-4-phenyl-, cis- is 2033-27-4.
What is the molecular formula of m-Dioxane, 5-methyl-4-phenyl-, cis-?
The molecular formula of m-Dioxane, 5-methyl-4-phenyl-, cis- is C11H14O2.
What is the molecular weight of m-Dioxane, 5-methyl-4-phenyl-, cis-?
The molecular weight of m-Dioxane, 5-methyl-4-phenyl-, cis- is 178.10 g/mol.
Where can I buy m-Dioxane, 5-methyl-4-phenyl-, cis-?
You can request a quote for m-Dioxane, 5-methyl-4-phenyl-, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Dioxane, 5-methyl-4-phenyl-, cis-?
Yes, KEHONG BIO provides custom synthesis services for m-Dioxane, 5-methyl-4-phenyl-, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.