Bromomalonic acid
TL;DR: Bromomalonic acid (CAS 600-31-7) is a chemical compound with molecular formula C3H3BrO4 and molecular weight 181.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromopropanedioic acid
Also Known As: 2-bromopropanedioic acid, Propanedioic acid, bromo-, 2-bromomalonic acid, BROMOMALONIC ACID, Monobromomalonic Acid
| Molecular Formula | C3H3BrO4 |
|---|---|
| Molecular Weight | 181.92 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.92146 |
| Heavy Atoms | 8 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 600-31-7 |
|---|---|
| SMILES | C(C(=O)O)(C(=O)O)Br |
| InChIKey | VBZOUUJVGADJBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bromomalonic acid (CAS 600-31-7), with molecular formula C3H3BrO4 and molecular weight 181.92 g/mol. IUPAC: 2-bromopropanedioic acid.
Chemical Property Profile of Bromomalonic acid
Property Insights of Bromomalonic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromomalonic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Bromomalonic acid. Following Lipinski's Rule of Five, Bromomalonic acid has 2 hydrogen bond donor(s) and 4 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 Bromomalonic acid?
The CAS number of Bromomalonic acid is 600-31-7.
What is the molecular formula of Bromomalonic acid?
The molecular formula of Bromomalonic acid is C3H3BrO4.
What is the molecular weight of Bromomalonic acid?
The molecular weight of Bromomalonic acid is 181.92 g/mol.
Where can I buy Bromomalonic acid?
You can request a quote for Bromomalonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromomalonic acid?
Yes, KEHONG BIO provides custom synthesis services for Bromomalonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.