Bromoacetylaminoisophthalic acid
TL;DR: Bromoacetylaminoisophthalic acid (CAS 61389-10-4) is a chemical compound with molecular formula C10H8BrNO5 and molecular weight 300.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[acetyl(bromo)amino]benzene-1,3-dicarboxylic acid
Also Known As: Bromoacetylaminoisophthalic acid, 5-(2-bromoacetamido)isophthalic acid, 2-[acetyl(bromo)amino]benzene-1,3-dicarboxylic acid, 1,3-Benzenedicarboxylic acid, 5-((bromoacetyl)amino)-, 1,3-Benzenedicarboxylicacid, 5-[(2-bromoacetyl)amino]-
| Molecular Formula | C10H8BrNO5 |
|---|---|
| Molecular Weight | 300.96 g/mol |
| LogP | 1.7458 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.9586 |
| Heavy Atoms | 17 |
| Complexity | 467.21967 |
Chemical Identifiers
| CAS Number | 61389-10-4 |
|---|---|
| SMILES | CC(=O)N(C1=C(C=CC=C1C(=O)O)C(=O)O)Br |
Product Overview
Bromoacetylaminoisophthalic acid (CAS 61389-10-4), with molecular formula C10H8BrNO5 and molecular weight 300.96 g/mol. IUPAC: 2-[acetyl(bromo)amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of Bromoacetylaminoisophthalic acid
Property Insights of Bromoacetylaminoisophthalic acid
The XLogP value of 1.7458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromoacetylaminoisophthalic acid. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Bromoacetylaminoisophthalic acid. Following Lipinski's Rule of Five, Bromoacetylaminoisophthalic acid has 2 hydrogen bond donor(s) and 3 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 Bromoacetylaminoisophthalic acid?
The CAS number of Bromoacetylaminoisophthalic acid is 61389-10-4.
What is the molecular formula of Bromoacetylaminoisophthalic acid?
The molecular formula of Bromoacetylaminoisophthalic acid is C10H8BrNO5.
What is the molecular weight of Bromoacetylaminoisophthalic acid?
The molecular weight of Bromoacetylaminoisophthalic acid is 300.96 g/mol.
Where can I buy Bromoacetylaminoisophthalic acid?
You can request a quote for Bromoacetylaminoisophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromoacetylaminoisophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for Bromoacetylaminoisophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.