2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid
TL;DR: 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid (CAS 30007-57-9) is a chemical compound with molecular formula C11H8BrNO4 and molecular weight 296.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid
Also Known As: 2-bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid, 2-bromo-3-phthalimido-propionic acid, 2-Bromo-3-(1,3-dioxo-2-isoindolinyl)propanoic Acid, 2-Bromo-3-(1,3-dioxoisoindolin-2-yl)propanoic acid, 2-Bromo-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid
| Molecular Formula | C11H8BrNO4 |
|---|---|
| Molecular Weight | 296.96 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.96368 |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 30007-57-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CC(C(=O)O)Br |
| InChIKey | KDBHFOHTCIFMNU-UHFFFAOYSA-N |
Product Overview
2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid (CAS 30007-57-9), with molecular formula C11H8BrNO4 and molecular weight 296.96 g/mol. IUPAC: 2-bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid.
Chemical Property Profile of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid
Property Insights of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid. Following Lipinski's Rule of Five, 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid has 1 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 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid?
The CAS number of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid is 30007-57-9.
What is the molecular formula of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid?
The molecular formula of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid is C11H8BrNO4.
What is the molecular weight of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid?
The molecular weight of 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid is 296.96 g/mol.
Where can I buy 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid?
You can request a quote for 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-3-(1,3-dioxoisoindol-2-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.