N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride
TL;DR: N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride (CAS 355148-26-4) is a chemical compound with molecular formula C9H8ClN3O4 and molecular weight 257.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-chloroethylideneamino) N-(3-nitrophenyl)carbamate
Also Known As: (1-chloroethylideneamino) N-(3-nitrophenyl)carbamate, N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride, (E)-(1-chloroethylidene)amino N-(3-nitrophenyl)carbamate, (2-chloro-1-azaprop-1-enyloxy)-N-(3-nitrophenyl)carboxamide
| Molecular Formula | C9H8ClN3O4 |
|---|---|
| Molecular Weight | 257.02 g/mol |
| LogP | 2.7155 |
| Topological Polar Surface Area | 93.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.02032 |
| Heavy Atoms | 17 |
| Complexity | 471.0637 |
Chemical Identifiers
| CAS Number | 355148-26-4 |
|---|---|
| SMILES | CC(=NOC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])Cl |
Product Overview
N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride (CAS 355148-26-4), with molecular formula C9H8ClN3O4 and molecular weight 257.02 g/mol. IUPAC: (1-chloroethylideneamino) N-(3-nitrophenyl)carbamate.
Chemical Property Profile of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride
Property Insights of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride
The XLogP value of 2.7155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride. The TPSA of 93.83 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride. Following Lipinski's Rule of Five, N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride has 1 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 N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride?
The CAS number of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride is 355148-26-4.
What is the molecular formula of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride?
The molecular formula of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride is C9H8ClN3O4.
What is the molecular weight of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride?
The molecular weight of N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride is 257.02 g/mol.
Where can I buy N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride?
You can request a quote for N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for N-{[(3-nitrophenyl)carbamoyl]oxy}ethanimidoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.