2-Amino-3-(3-nitrophenyl)pentanedioic acid
TL;DR: 2-Amino-3-(3-nitrophenyl)pentanedioic acid (CAS 36727-99-8) is a chemical compound with molecular formula C11H12N2O6 and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-(3-nitrophenyl)pentanedioic acid
Also Known As: 3-(3-Nitrophenyl)glutamic acid, 2-amino-3-(3-nitrophenyl)pentanedioic acid
| Molecular Formula | C11H12N2O6 |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.06955 |
| Heavy Atoms | 19 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 36727-99-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)O)C(C(=O)O)N |
| InChIKey | VUXRFNSDQAXSDQ-UHFFFAOYSA-N |
Product Overview
2-Amino-3-(3-nitrophenyl)pentanedioic acid (CAS 36727-99-8), with molecular formula C11H12N2O6 and molecular weight 268.07 g/mol. IUPAC: 2-amino-3-(3-nitrophenyl)pentanedioic acid.
Chemical Property Profile of 2-Amino-3-(3-nitrophenyl)pentanedioic acid
Property Insights of 2-Amino-3-(3-nitrophenyl)pentanedioic acid
The XLogP value of -2.3 indicates that 2-Amino-3-(3-nitrophenyl)pentanedioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting 2-Amino-3-(3-nitrophenyl)pentanedioic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Amino-3-(3-nitrophenyl)pentanedioic acid has 3 hydrogen bond donor(s) and 7 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-Amino-3-(3-nitrophenyl)pentanedioic acid?
The CAS number of 2-Amino-3-(3-nitrophenyl)pentanedioic acid is 36727-99-8.
What is the molecular formula of 2-Amino-3-(3-nitrophenyl)pentanedioic acid?
The molecular formula of 2-Amino-3-(3-nitrophenyl)pentanedioic acid is C11H12N2O6.
What is the molecular weight of 2-Amino-3-(3-nitrophenyl)pentanedioic acid?
The molecular weight of 2-Amino-3-(3-nitrophenyl)pentanedioic acid is 268.07 g/mol.
Where can I buy 2-Amino-3-(3-nitrophenyl)pentanedioic acid?
You can request a quote for 2-Amino-3-(3-nitrophenyl)pentanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-(3-nitrophenyl)pentanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-(3-nitrophenyl)pentanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.