3-(3-溴苯基)丙烯酸
TL;DR: 3-(3-溴苯基)丙烯酸 (CAS 32862-97-8) is a chemical compound with molecular formula C9H7BrO2 and molecular weight 225.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-溴苯基)丙烯酸
3-(3-bromophenyl)prop-2-enoic acid
Also Known As: 3-Bromocinnamic acid, 3-(3-Bromophenyl)acrylic acid, trans-3-Bromocinnamic acid, M-BROMOCINNAMIC ACID, m-BROMO CINNAMIC ACID
| Molecular Formula | C9H7BrO2 |
|---|---|
| Molecular Weight | 225.96 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.96294 |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 32862-97-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C=CC(=O)O |
| InChIKey | YEMUSDCFQUBPAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-溴苯基)丙烯酸 (CAS 32862-97-8), with molecular formula C9H7BrO2 and molecular weight 225.96 g/mol. IUPAC: 3-(3-bromophenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(3-溴苯基)丙烯酸
Property Insights of 3-(3-溴苯基)丙烯酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-溴苯基)丙烯酸. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(3-溴苯基)丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-溴苯基)丙烯酸 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-(3-溴苯基)丙烯酸?
The CAS number of 3-(3-溴苯基)丙烯酸 is 32862-97-8.
What is the molecular formula of 3-(3-溴苯基)丙烯酸?
The molecular formula of 3-(3-溴苯基)丙烯酸 is C9H7BrO2.
What is the molecular weight of 3-(3-溴苯基)丙烯酸?
The molecular weight of 3-(3-溴苯基)丙烯酸 is 225.96 g/mol.
Where can I buy 3-(3-溴苯基)丙烯酸?
You can request a quote for 3-(3-溴苯基)丙烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-溴苯基)丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-溴苯基)丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.