4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid
TL;DR: 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid (CAS 137232-04-3) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-amino-2,4-dioxoazetidin-1-yl)-2-methylbenzoic acid
Also Known As: 4-Aabc, 4- methylbenzoicacid, 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid, 4-(3-amino-2,4-dioxoazetidin-1-yl)-2-methylbenzoic acid, RefChem:97126
| Molecular Formula | C11H10N2O4 |
|---|---|
| Molecular Weight | 234.06 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.06406 |
| Heavy Atoms | 17 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 137232-04-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N2C(=O)C(C2=O)N)C(=O)O |
| InChIKey | NVIJVMZHQKJLID-UHFFFAOYSA-N |
Product Overview
4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid (CAS 137232-04-3), with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol. IUPAC: 4-(3-amino-2,4-dioxoazetidin-1-yl)-2-methylbenzoic acid.
Chemical Property Profile of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid
Property Insights of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid
The XLogP value of -2.2 indicates that 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid. Following Lipinski's Rule of Five, 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid has 2 hydrogen bond donor(s) and 5 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-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid?
The CAS number of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid is 137232-04-3.
What is the molecular formula of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid?
The molecular formula of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid is C11H10N2O4.
What is the molecular weight of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid?
The molecular weight of 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid is 234.06 g/mol.
Where can I buy 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid?
You can request a quote for 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Amino-2-oxoazetidinonyl-1)methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.