4-Chloro-3'-nitrobenzophenone
TL;DR: 4-Chloro-3'-nitrobenzophenone (CAS 62810-38-2) is a chemical compound with molecular formula C13H8ClNO3 and molecular weight 261.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-(3-nitrophenyl)methanone
Also Known As: 4-CHLORO-3'-NITROBENZOPHENONE, (4-chlorophenyl)-(3-nitrophenyl)methanone, 4'-chloro-3-nitrobenzophenone, 3-Nitro-4'-Chlorobenzophenone, CHEMBRDG-BB 5485456
| Molecular Formula | C13H8ClNO3 |
|---|---|
| Molecular Weight | 261.02 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.01926 |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 62810-38-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=CC=C(C=C2)Cl |
| InChIKey | WANOJUMUCWLVTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-3'-nitrobenzophenone (CAS 62810-38-2), with molecular formula C13H8ClNO3 and molecular weight 261.02 g/mol. IUPAC: (4-chlorophenyl)-(3-nitrophenyl)methanone.
Chemical Property Profile of 4-Chloro-3'-nitrobenzophenone
Property Insights of 4-Chloro-3'-nitrobenzophenone
The XLogP value of 3.7 indicates that 4-Chloro-3'-nitrobenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3'-nitrobenzophenone. Following Lipinski's Rule of Five, 4-Chloro-3'-nitrobenzophenone 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 4-Chloro-3'-nitrobenzophenone?
The CAS number of 4-Chloro-3'-nitrobenzophenone is 62810-38-2.
What is the molecular formula of 4-Chloro-3'-nitrobenzophenone?
The molecular formula of 4-Chloro-3'-nitrobenzophenone is C13H8ClNO3.
What is the molecular weight of 4-Chloro-3'-nitrobenzophenone?
The molecular weight of 4-Chloro-3'-nitrobenzophenone is 261.02 g/mol.
Where can I buy 4-Chloro-3'-nitrobenzophenone?
You can request a quote for 4-Chloro-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-Chloro-3'-nitrobenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3'-nitrobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.