2-氯-N,N-二甲基-4-硝基苯胺
TL;DR: 2-氯-N,N-二甲基-4-硝基苯胺 (CAS 6213-19-0) is a chemical compound with molecular formula C8H9ClN2O2 and molecular weight 200.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-N,N-二甲基-4-硝基苯胺
2-chloro-N,N-dimethyl-4-nitroaniline
Also Known As: 2-Chloro-N,N-dimethyl-4-nitroaniline, 2-Chloro-NN-dimethyl-4-nitroaniline, N,N-Dimethyl-4-nitro-2-chloroaniline, 2-Chloro-N,N-dimethyl-4-nitrobenzenamine, 3-Chloro-4-dimethylaminonitrobenzene
| Molecular Formula | C8H9ClN2O2 |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.03525 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 6213-19-0 |
|---|---|
| SMILES | CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])Cl |
| InChIKey | OZKAWTHGBGLZKC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-N,N-二甲基-4-硝基苯胺 (CAS 6213-19-0), with molecular formula C8H9ClN2O2 and molecular weight 200.04 g/mol. IUPAC: 2-chloro-N,N-dimethyl-4-nitroaniline.
Chemical Property Profile of 2-氯-N,N-二甲基-4-硝基苯胺
Property Insights of 2-氯-N,N-二甲基-4-硝基苯胺
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-N,N-二甲基-4-硝基苯胺. With a topological polar surface area (TPSA) of 49.1 Ų, 2-氯-N,N-二甲基-4-硝基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-N,N-二甲基-4-硝基苯胺 has 0 hydrogen bond donor(s) and 3 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 2-氯-N,N-二甲基-4-硝基苯胺?
The CAS number of 2-氯-N,N-二甲基-4-硝基苯胺 is 6213-19-0.
What is the molecular formula of 2-氯-N,N-二甲基-4-硝基苯胺?
The molecular formula of 2-氯-N,N-二甲基-4-硝基苯胺 is C8H9ClN2O2.
What is the molecular weight of 2-氯-N,N-二甲基-4-硝基苯胺?
The molecular weight of 2-氯-N,N-二甲基-4-硝基苯胺 is 200.04 g/mol.
Where can I buy 2-氯-N,N-二甲基-4-硝基苯胺?
You can request a quote for 2-氯-N,N-二甲基-4-硝基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-N,N-二甲基-4-硝基苯胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-N,N-二甲基-4-硝基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.