二甲基氨基甲酸-3-硝基苯酯
TL;DR: 二甲基氨基甲酸-3-硝基苯酯 (CAS 7304-99-6) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二甲基氨基甲酸-3-硝基苯酯
(3-nitrophenyl) N,N-dimethylcarbamate
Also Known As: 3-nitrophenyl dimethylcarbamate, (3-nitrophenyl) N,N-dimethylcarbamate, dimethyl m-nitrobenzenecarbamate, Carbamic acid, dimethyl-, 3-nitrophenyl ester, 3-nitrophenyl N,N-dimethylcarbamate
| Molecular Formula | C9H10N2O4 |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.06406 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 7304-99-6 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC=CC(=C1)[N+](=O)[O-] |
| InChIKey | ABXVZVIOAYTALB-UHFFFAOYSA-N |
Product Overview
二甲基氨基甲酸-3-硝基苯酯 (CAS 7304-99-6), with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol. IUPAC: (3-nitrophenyl) N,N-dimethylcarbamate.
Chemical Property Profile of 二甲基氨基甲酸-3-硝基苯酯
Property Insights of 二甲基氨基甲酸-3-硝基苯酯
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二甲基氨基甲酸-3-硝基苯酯. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 二甲基氨基甲酸-3-硝基苯酯. Following Lipinski's Rule of Five, 二甲基氨基甲酸-3-硝基苯酯 has 0 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 二甲基氨基甲酸-3-硝基苯酯?
The CAS number of 二甲基氨基甲酸-3-硝基苯酯 is 7304-99-6.
What is the molecular formula of 二甲基氨基甲酸-3-硝基苯酯?
The molecular formula of 二甲基氨基甲酸-3-硝基苯酯 is C9H10N2O4.
What is the molecular weight of 二甲基氨基甲酸-3-硝基苯酯?
The molecular weight of 二甲基氨基甲酸-3-硝基苯酯 is 210.06 g/mol.
Where can I buy 二甲基氨基甲酸-3-硝基苯酯?
You can request a quote for 二甲基氨基甲酸-3-硝基苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二甲基氨基甲酸-3-硝基苯酯?
Yes, KEHONG BIO provides custom synthesis services for 二甲基氨基甲酸-3-硝基苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.