(4-Methylphenyl)methyl prop-2-enoate
TL;DR: (4-Methylphenyl)methyl prop-2-enoate (CAS 91990-21-5) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)methyl prop-2-enoate
Also Known As: (4-methylphenyl)methyl Prop-2-enoate, 2-Propenoicacid,(4-methylphenyl)methylester
| Molecular Formula | C11H12O2 |
|---|---|
| Molecular Weight | 176.08 g/mol |
| LogP | 2.22422 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.08372 |
| Heavy Atoms | 13 |
| Complexity | 298.37125 |
Chemical Identifiers
| CAS Number | 91990-21-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)COC(=O)C=C |
Product Overview
(4-Methylphenyl)methyl prop-2-enoate (CAS 91990-21-5), with molecular formula C11H12O2 and molecular weight 176.08 g/mol. IUPAC: (4-methylphenyl)methyl prop-2-enoate.
Chemical Property Profile of (4-Methylphenyl)methyl prop-2-enoate
Property Insights of (4-Methylphenyl)methyl prop-2-enoate
The XLogP value of 2.22422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methylphenyl)methyl prop-2-enoate. With a topological polar surface area (TPSA) of 26.3 Ų, (4-Methylphenyl)methyl prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methylphenyl)methyl prop-2-enoate 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 (4-Methylphenyl)methyl prop-2-enoate?
The CAS number of (4-Methylphenyl)methyl prop-2-enoate is 91990-21-5.
What is the molecular formula of (4-Methylphenyl)methyl prop-2-enoate?
The molecular formula of (4-Methylphenyl)methyl prop-2-enoate is C11H12O2.
What is the molecular weight of (4-Methylphenyl)methyl prop-2-enoate?
The molecular weight of (4-Methylphenyl)methyl prop-2-enoate is 176.08 g/mol.
Where can I buy (4-Methylphenyl)methyl prop-2-enoate?
You can request a quote for (4-Methylphenyl)methyl prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylphenyl)methyl prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylphenyl)methyl prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.