![2-[(4-Methylphenyl)methyl]-1,3-dioxolane structure](/static/products/4412/4412-50-4.webp)
2-[(4-Methylphenyl)methyl]-1,3-dioxolane
TL;DR: 2-[(4-Methylphenyl)methyl]-1,3-dioxolane (CAS 4412-50-4) 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.
2-[(4-methylphenyl)methyl]-1,3-dioxolane
Also Known As: 2-(4-Methylbenzyl)-1,3-dioxolane, 2-[(4-methylphenyl)methyl]-1,3-dioxolane, 4-(1,3-Dioxolan-2-ylmethyl)toluene, 4- TOLUENE, 1-(1,3-DIOXOLAN-2-YLMETHYL)-4-METHYLBENZENE
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 1.91042 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 259.9237 |
Chemical Identifiers
| CAS Number | 4412-50-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2OCCO2 |
Product Overview
2-[(4-Methylphenyl)methyl]-1,3-dioxolane (CAS 4412-50-4), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 2-[(4-methylphenyl)methyl]-1,3-dioxolane.
Chemical Property Profile of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane
Property Insights of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane
The XLogP value of 1.91042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Methylphenyl)methyl]-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.46 Ų, 2-[(4-Methylphenyl)methyl]-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Methylphenyl)methyl]-1,3-dioxolane 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 2-[(4-Methylphenyl)methyl]-1,3-dioxolane?
The CAS number of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane is 4412-50-4.
What is the molecular formula of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane?
The molecular formula of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane is C11H14O2.
What is the molecular weight of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane?
The molecular weight of 2-[(4-Methylphenyl)methyl]-1,3-dioxolane is 178.10 g/mol.
Where can I buy 2-[(4-Methylphenyl)methyl]-1,3-dioxolane?
You can request a quote for 2-[(4-Methylphenyl)methyl]-1,3-dioxolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Methylphenyl)methyl]-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Methylphenyl)methyl]-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.