![Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) structure](/static/products/3028/30288-95-0.webp)
Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)
TL;DR: Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) (CAS 30288-95-0) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-nitrophenyl)ethylideneamino] N,N-dimethylcarbamate
Also Known As: [(Z)-1-(4-nitrophenyl)ethylideneamino] N,N-dimethylcarbamate|ETHANONE,1-(4-NITROPHENYL)-, O-[(DIMETHYLAMINO)CARBONYL]OXIME (9CI)
| Molecular Formula | C11H13N3O4 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.0906 |
| Heavy Atoms | 18 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 30288-95-0 |
|---|---|
| SMILES | CC(=NOC(=O)N(C)C)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | AYAUULWEJLHDHA-UHFFFAOYSA-N |
Product Overview
Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) (CAS 30288-95-0), with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol. IUPAC: [1-(4-nitrophenyl)ethylideneamino] N,N-dimethylcarbamate.
Chemical Property Profile of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)
Property Insights of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI). The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI). Following Lipinski's Rule of Five, Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) 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 Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)?
The CAS number of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) is 30288-95-0.
What is the molecular formula of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)?
The molecular formula of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) is C11H13N3O4.
What is the molecular weight of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)?
The molecular weight of Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) is 251.09 g/mol.
Where can I buy Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)?
You can request a quote for Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI)?
Yes, KEHONG BIO provides custom synthesis services for Ethanone,1-(4-nitrophenyl)-, O-[(dimethylamino)carbonyl]oxime (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.