![4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile structure](/static/products/6909/69094-15-1.webp)
4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile
TL;DR: 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile (CAS 69094-15-1) is a chemical compound with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-5-[(2-oxo-1,3-oxazolidin-3-yl)imino]pentanenitrile
Also Known As: COBAO, 3-(4-Cyano-2-oxobutylideneamino)-2-oxazolidone, 3-(4-Cyano-2-oxobutylideneamino)-2-oxazolidinone, Pentanenitrile,4-oxo-5-[(2-oxo-3-oxazolidinyl)imino]-, 4-OXO-5-[(2-OXO-1,3-OXAZOLIDIN-3-YL)IMINO]PENTANENITRILE
| Molecular Formula | C8H9N3O3 |
|---|---|
| Molecular Weight | 195.06 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 82.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.06439 |
| Heavy Atoms | 14 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 69094-15-1 |
|---|---|
| SMILES | C1COC(=O)N1N=CC(=O)CCC#N |
| InChIKey | GYCZNUWWKOYJHU-UHFFFAOYSA-N |
Product Overview
4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile (CAS 69094-15-1), with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol. IUPAC: 4-oxo-5-[(2-oxo-1,3-oxazolidin-3-yl)imino]pentanenitrile.
Chemical Property Profile of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile
Property Insights of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile
The XLogP value of -0.6 indicates that 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile. Following Lipinski's Rule of Five, 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile has 0 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-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile?
The CAS number of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile is 69094-15-1.
What is the molecular formula of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile?
The molecular formula of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile is C8H9N3O3.
What is the molecular weight of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile?
The molecular weight of 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile is 195.06 g/mol.
Where can I buy 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile?
You can request a quote for 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-5-[(2-oxo-1,3-oxazolidin-3-YL)imino]pentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.