5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate
TL;DR: 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate (CAS 1092786-48-5) is a chemical compound with molecular formula C19H22N2O11 and molecular weight 454.12234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2,3,4-triacetyloxy-5-(3-nitroanilino)-5-oxopentyl] acetate
Also Known As: UPCMLD0ENAT0503-7392:001, [2,3,4-triacetyloxy-5-(3-nitroanilino)-5-oxopentyl] acetate, [1,3,4-triacetyloxy-1-[(3-nitrophenyl)carbamoyl]butan-2-yl] Acetate, 5-((3-nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate, 5-[(3-nitrophenyl)amino]-5-oxopentane-1,2,3,4-tetrayl tetraacetate (non-preferred name)
Technical Specifications
| Molecular Formula | C19H22N2O11 |
| Molecular Weight | 454.12234 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 454.12234 Da |
| Heavy Atoms | 32 |
| Complexity | 733.0 |
| SMILES | CC(=O)OCC(C(C(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | HGXRAUFWURMKDN-UHFFFAOYSA-N |
Chemical Property Profile of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate
Property Insights of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate. The TPSA of 180.0 Ų indicates high polarity, suggesting 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate?
The CAS number of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate is 1092786-48-5.
What is the molecular formula of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate?
The molecular formula of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate is C19H22N2O11.
What is the molecular weight of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate?
The molecular weight of 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate is 454.12234 g/mol.
Where can I buy 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate?
You can request a quote for 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate?
Yes, CoreyChem provides custom synthesis services for 5-((3-Nitrophenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.