Benzenamine, 4-chloro-N-ethyl-2-nitro-
TL;DR: Benzenamine, 4-chloro-N-ethyl-2-nitro- (CAS 28491-95-4) 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.
4-chloro-N-ethyl-2-nitroaniline
Also Known As: 4-Chloro-N-ethyl-2-nitroaniline, n-ethyl-4-chloro-2-nitroaniline, Maybridge1_008530, N-ETHYL 4-CHLORO-2-NITROANILINE, Benzenamine, 4-chloro-N-ethyl-2-nitro-
| Molecular Formula | C8H9ClN2O2 |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.03525 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 28491-95-4 |
|---|---|
| SMILES | CCNC1=C(C=C(C=C1)Cl)[N+](=O)[O-] |
| InChIKey | PVIUZYZWJNQCIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, 4-chloro-N-ethyl-2-nitro- (CAS 28491-95-4), with molecular formula C8H9ClN2O2 and molecular weight 200.04 g/mol. IUPAC: 4-chloro-N-ethyl-2-nitroaniline.
Chemical Property Profile of Benzenamine, 4-chloro-N-ethyl-2-nitro-
Property Insights of Benzenamine, 4-chloro-N-ethyl-2-nitro-
The XLogP value of 3.2 indicates that Benzenamine, 4-chloro-N-ethyl-2-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.9 Ų, Benzenamine, 4-chloro-N-ethyl-2-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 4-chloro-N-ethyl-2-nitro- has 1 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 Benzenamine, 4-chloro-N-ethyl-2-nitro-?
The CAS number of Benzenamine, 4-chloro-N-ethyl-2-nitro- is 28491-95-4.
What is the molecular formula of Benzenamine, 4-chloro-N-ethyl-2-nitro-?
The molecular formula of Benzenamine, 4-chloro-N-ethyl-2-nitro- is C8H9ClN2O2.
What is the molecular weight of Benzenamine, 4-chloro-N-ethyl-2-nitro-?
The molecular weight of Benzenamine, 4-chloro-N-ethyl-2-nitro- is 200.04 g/mol.
Where can I buy Benzenamine, 4-chloro-N-ethyl-2-nitro-?
You can request a quote for Benzenamine, 4-chloro-N-ethyl-2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 4-chloro-N-ethyl-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 4-chloro-N-ethyl-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.