2-(4-Bromo-3-methylphenyl)acetic acid
TL;DR: 2-(4-Bromo-3-methylphenyl)acetic acid (CAS 215949-57-8) is a chemical compound with molecular formula C9H9BrO2 and molecular weight 227.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-3-methylphenyl)acetic acid
Also Known As: 2-(4-bromo-3-methylphenyl)acetic acid, 4-BROMO-3-METHYLPHENYLACETIC ACID, (4-Bromo-3-methylphenyl)acetic acid, 19-Hydroxysubstances, 4-Bromo-3-methylbenzeneacetic acid
| Molecular Formula | C9H9BrO2 |
|---|---|
| Molecular Weight | 227.98 g/mol |
| LogP | 2.38462 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.97859 |
| Heavy Atoms | 12 |
| Complexity | 307.39688 |
Chemical Identifiers
| CAS Number | 215949-57-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CC(=O)O)Br |
Product Overview
2-(4-Bromo-3-methylphenyl)acetic acid (CAS 215949-57-8), with molecular formula C9H9BrO2 and molecular weight 227.98 g/mol. IUPAC: 2-(4-bromo-3-methylphenyl)acetic acid.
Chemical Property Profile of 2-(4-Bromo-3-methylphenyl)acetic acid
Property Insights of 2-(4-Bromo-3-methylphenyl)acetic acid
The XLogP value of 2.38462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromo-3-methylphenyl)acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(4-Bromo-3-methylphenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromo-3-methylphenyl)acetic acid has 1 hydrogen bond donor(s) and 1 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-Bromo-3-methylphenyl)acetic acid?
The CAS number of 2-(4-Bromo-3-methylphenyl)acetic acid is 215949-57-8.
What is the molecular formula of 2-(4-Bromo-3-methylphenyl)acetic acid?
The molecular formula of 2-(4-Bromo-3-methylphenyl)acetic acid is C9H9BrO2.
What is the molecular weight of 2-(4-Bromo-3-methylphenyl)acetic acid?
The molecular weight of 2-(4-Bromo-3-methylphenyl)acetic acid is 227.98 g/mol.
Where can I buy 2-(4-Bromo-3-methylphenyl)acetic acid?
You can request a quote for 2-(4-Bromo-3-methylphenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-3-methylphenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-3-methylphenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.