3-Bromopropionic acid
TL;DR: 3-Bromopropionic acid (CAS 590-92-1) is a chemical compound with molecular formula C3H5BrO2 and molecular weight 151.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromopropanoic acid
Also Known As: 3-Bromopropionic acid, 3-BROMOPROPANOIC ACID, Propanoic acid, 3-bromo-, beta-Bromopropionic acid, 2-Carboxyethyl bromide
| Molecular Formula | C3H5BrO2 |
|---|---|
| Molecular Weight | 151.95 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 151.9473 |
| Heavy Atoms | 6 |
| Complexity | 52.0 |
| Melting Point | 62.5 °C |
| Boiling Point | 140-142 °C @ 45 MM HG |
| Density | 1.48 |
| Solubility | SOL IN WATER, ETHER, CHLOROFORM, BENZENE, ALC |
Chemical Identifiers
| CAS Number | 590-92-1 |
|---|---|
| SMILES | C(CBr)C(=O)O |
| InChIKey | DHXNZYCXMFBMHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromopropionic acid (CAS 590-92-1), with molecular formula C3H5BrO2 and molecular weight 151.95 g/mol. IUPAC: 3-bromopropanoic acid.
Chemical Property Profile of 3-Bromopropionic acid
Property Insights of 3-Bromopropionic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromopropionic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Bromopropionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromopropionic 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-Bromopropionic acid?
The CAS number of 3-Bromopropionic acid is 590-92-1.
What is the molecular formula of 3-Bromopropionic acid?
The molecular formula of 3-Bromopropionic acid is C3H5BrO2.
What is the molecular weight of 3-Bromopropionic acid?
The molecular weight of 3-Bromopropionic acid is 151.95 g/mol.
Where can I buy 3-Bromopropionic acid?
You can request a quote for 3-Bromopropionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromopropionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromopropionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.