2-Benzyl-2-bromopropanedioic acid
TL;DR: 2-Benzyl-2-bromopropanedioic acid (CAS 74144-45-9) is a chemical compound with molecular formula C10H9BrO4 and molecular weight 271.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-2-bromopropanedioic acid
Also Known As: Benzylbrommalonsaure, benzyl-bromo-malonic acid, 2-benzyl-2-bromomalonic acid, 2-benzyl-2-bromopropanedioic acid
| Molecular Formula | C10H9BrO4 |
|---|---|
| Molecular Weight | 271.97 g/mol |
| LogP | 1.532 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.9684 |
| Heavy Atoms | 15 |
| Complexity | 360.2686 |
Chemical Identifiers
| CAS Number | 74144-45-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)(C(=O)O)Br |
Product Overview
2-Benzyl-2-bromopropanedioic acid (CAS 74144-45-9), with molecular formula C10H9BrO4 and molecular weight 271.97 g/mol. IUPAC: 2-benzyl-2-bromopropanedioic acid.
Chemical Property Profile of 2-Benzyl-2-bromopropanedioic acid
Property Insights of 2-Benzyl-2-bromopropanedioic acid
The XLogP value of 1.532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-2-bromopropanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzyl-2-bromopropanedioic acid. Following Lipinski's Rule of Five, 2-Benzyl-2-bromopropanedioic acid has 2 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 2-Benzyl-2-bromopropanedioic acid?
The CAS number of 2-Benzyl-2-bromopropanedioic acid is 74144-45-9.
What is the molecular formula of 2-Benzyl-2-bromopropanedioic acid?
The molecular formula of 2-Benzyl-2-bromopropanedioic acid is C10H9BrO4.
What is the molecular weight of 2-Benzyl-2-bromopropanedioic acid?
The molecular weight of 2-Benzyl-2-bromopropanedioic acid is 271.97 g/mol.
Where can I buy 2-Benzyl-2-bromopropanedioic acid?
You can request a quote for 2-Benzyl-2-bromopropanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-2-bromopropanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-2-bromopropanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.