(3,4-Dinitrophenyl)(phenyl)methanone
TL;DR: (3,4-Dinitrophenyl)(phenyl)methanone (CAS 33609-48-2) is a chemical compound with molecular formula C13H8N2O5 and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dinitrophenyl)-phenylmethanone
Also Known As: 3,4-Dinitrobenzophenone, (3,4-Dinitrophenyl)(phenyl)methanone, (3,4-dinitrophenyl)-phenylmethanone, (3,4-dinitrophenyl)-phenyl-methanone, J1.979.854B
| Molecular Formula | C13H8N2O5 |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.04333 |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 33609-48-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | BABWJHLNEZRUHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,4-Dinitrophenyl)(phenyl)methanone (CAS 33609-48-2), with molecular formula C13H8N2O5 and molecular weight 272.04 g/mol. IUPAC: (3,4-dinitrophenyl)-phenylmethanone.
Chemical Property Profile of (3,4-Dinitrophenyl)(phenyl)methanone
Property Insights of (3,4-Dinitrophenyl)(phenyl)methanone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Dinitrophenyl)(phenyl)methanone. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,4-Dinitrophenyl)(phenyl)methanone. Following Lipinski's Rule of Five, (3,4-Dinitrophenyl)(phenyl)methanone has 0 hydrogen bond donor(s) and 5 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 (3,4-Dinitrophenyl)(phenyl)methanone?
The CAS number of (3,4-Dinitrophenyl)(phenyl)methanone is 33609-48-2.
What is the molecular formula of (3,4-Dinitrophenyl)(phenyl)methanone?
The molecular formula of (3,4-Dinitrophenyl)(phenyl)methanone is C13H8N2O5.
What is the molecular weight of (3,4-Dinitrophenyl)(phenyl)methanone?
The molecular weight of (3,4-Dinitrophenyl)(phenyl)methanone is 272.04 g/mol.
Where can I buy (3,4-Dinitrophenyl)(phenyl)methanone?
You can request a quote for (3,4-Dinitrophenyl)(phenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dinitrophenyl)(phenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dinitrophenyl)(phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.