4-Amino-3-nitrobenzophenone
TL;DR: 4-Amino-3-nitrobenzophenone (CAS 5181-73-7) is a chemical compound with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-3-nitrophenyl)-phenylmethanone
Also Known As: 4-Amino-3-nitrobenzophenone, (4-Amino-3-nitrophenyl)(phenyl)methanone, Not Available, 4-benzoyl-2-nitroaniline, (4-Amino-3-nitrophenyl)phenylmethanone
| Molecular Formula | C13H10N2O3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.06914 |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 5181-73-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-] |
| InChIKey | NGOOFAMQPUEDJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-3-nitrobenzophenone (CAS 5181-73-7), with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol. IUPAC: (4-amino-3-nitrophenyl)-phenylmethanone.
Chemical Property Profile of 4-Amino-3-nitrobenzophenone
Property Insights of 4-Amino-3-nitrobenzophenone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-nitrobenzophenone. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-nitrobenzophenone. Following Lipinski's Rule of Five, 4-Amino-3-nitrobenzophenone 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 4-Amino-3-nitrobenzophenone?
The CAS number of 4-Amino-3-nitrobenzophenone is 5181-73-7.
What is the molecular formula of 4-Amino-3-nitrobenzophenone?
The molecular formula of 4-Amino-3-nitrobenzophenone is C13H10N2O3.
What is the molecular weight of 4-Amino-3-nitrobenzophenone?
The molecular weight of 4-Amino-3-nitrobenzophenone is 242.07 g/mol.
Where can I buy 4-Amino-3-nitrobenzophenone?
You can request a quote for 4-Amino-3-nitrobenzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-3-nitrobenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-3-nitrobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.