N-(2-甲基-4-硝基苯基)氨基甲酸苄酯
TL;DR: N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 (CAS 120599-90-8) is a chemical compound with molecular formula C15H14N2O4 and molecular weight 286.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-甲基-4-硝基苯基)氨基甲酸苄酯
benzyl N-(2-methyl-4-nitrophenyl)carbamate
Also Known As: benzyl N-(2-methyl-4-nitrophenyl)carbamate, N-benzyloxycarbonyl-2-methyl-4-nitroaniline
| Molecular Formula | C15H14N2O4 |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.09537 |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 120599-90-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2 |
| InChIKey | HHRMVEUXQNUUEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 (CAS 120599-90-8), with molecular formula C15H14N2O4 and molecular weight 286.10 g/mol. IUPAC: benzyl N-(2-methyl-4-nitrophenyl)carbamate.
Chemical Property Profile of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯
Property Insights of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯
The XLogP value of 3.2 indicates that N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-甲基-4-硝基苯基)氨基甲酸苄酯. Following Lipinski's Rule of Five, N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 has 1 hydrogen bond donor(s) and 4 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-(2-甲基-4-硝基苯基)氨基甲酸苄酯?
The CAS number of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 is 120599-90-8.
What is the molecular formula of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯?
The molecular formula of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 is C15H14N2O4.
What is the molecular weight of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯?
The molecular weight of N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 is 286.10 g/mol.
Where can I buy N-(2-甲基-4-硝基苯基)氨基甲酸苄酯?
You can request a quote for N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-甲基-4-硝基苯基)氨基甲酸苄酯?
Yes, KEHONG BIO provides custom synthesis services for N-(2-甲基-4-硝基苯基)氨基甲酸苄酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.