3-(2-Methylphenyl)prop-2-enoic acid
TL;DR: 3-(2-Methylphenyl)prop-2-enoic acid (CAS 2373-76-4) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)prop-2-enoic acid
Also Known As: 2-Methylcinnamic Acid, o-Methylcinnamic acid, 5-bromovaniline, ss-Toluylacrylsaure, 2-Methylcinnamicacid
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 2373-76-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C=CC(=O)O |
| InChIKey | RSWBWHPZXKLUEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Methylphenyl)prop-2-enoic acid (CAS 2373-76-4), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: 3-(2-methylphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(2-Methylphenyl)prop-2-enoic acid
Property Insights of 3-(2-Methylphenyl)prop-2-enoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Methylphenyl)prop-2-enoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(2-Methylphenyl)prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methylphenyl)prop-2-enoic acid has 1 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 3-(2-Methylphenyl)prop-2-enoic acid?
The CAS number of 3-(2-Methylphenyl)prop-2-enoic acid is 2373-76-4.
What is the molecular formula of 3-(2-Methylphenyl)prop-2-enoic acid?
The molecular formula of 3-(2-Methylphenyl)prop-2-enoic acid is C10H10O2.
What is the molecular weight of 3-(2-Methylphenyl)prop-2-enoic acid?
The molecular weight of 3-(2-Methylphenyl)prop-2-enoic acid is 162.07 g/mol.
Where can I buy 3-(2-Methylphenyl)prop-2-enoic acid?
You can request a quote for 3-(2-Methylphenyl)prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methylphenyl)prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methylphenyl)prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.