4-Phthalimidobutyric acid
TL;DR: 4-Phthalimidobutyric acid (CAS 3130-75-4) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxoisoindol-2-yl)butanoic acid
Also Known As: 4-Phthalimidobutyric acid, 4-(1,3-dioxoisoindolin-2-yl)butanoic acid, N-Phthaloyl GABA, 4-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoic acid, 4-Phthalimidobuttersaure
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 3130-75-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)O |
| InChIKey | HMKSXJBFBVGLJJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Phthalimidobutyric acid (CAS 3130-75-4), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: 4-(1,3-dioxoisoindol-2-yl)butanoic acid.
Chemical Property Profile of 4-Phthalimidobutyric acid
Property Insights of 4-Phthalimidobutyric acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phthalimidobutyric acid. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Phthalimidobutyric acid. Following Lipinski's Rule of Five, 4-Phthalimidobutyric 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 4-Phthalimidobutyric acid?
The CAS number of 4-Phthalimidobutyric acid is 3130-75-4.
What is the molecular formula of 4-Phthalimidobutyric acid?
The molecular formula of 4-Phthalimidobutyric acid is C12H11NO4.
What is the molecular weight of 4-Phthalimidobutyric acid?
The molecular weight of 4-Phthalimidobutyric acid is 233.07 g/mol.
Where can I buy 4-Phthalimidobutyric acid?
You can request a quote for 4-Phthalimidobutyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phthalimidobutyric acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Phthalimidobutyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.