2-(4-Nitrobenzoyl)thiophene
TL;DR: 2-(4-Nitrobenzoyl)thiophene (CAS 34918-79-1) is a chemical compound with molecular formula C11H7NO3S and molecular weight 233.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl)-thiophen-2-ylmethanone
Also Known As: 2-(4-NITROBENZOYL)THIOPHENE, 2-p-Nitrobenzoylthiophene, (4-Nitrophenyl)(2-thienyl)methanone, (4-nitrophenyl)(thiophen-2-yl)methanone, 2-(p-nitrobenzoyl)thiophene
| Molecular Formula | C11H7NO3S |
|---|---|
| Molecular Weight | 233.01 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.01466 |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 34918-79-1 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | XUGHSFUXJPGCLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Nitrobenzoyl)thiophene (CAS 34918-79-1), with molecular formula C11H7NO3S and molecular weight 233.01 g/mol. IUPAC: (4-nitrophenyl)-thiophen-2-ylmethanone.
Chemical Property Profile of 2-(4-Nitrobenzoyl)thiophene
Property Insights of 2-(4-Nitrobenzoyl)thiophene
The XLogP value of 3.1 indicates that 2-(4-Nitrobenzoyl)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrobenzoyl)thiophene. Following Lipinski's Rule of Five, 2-(4-Nitrobenzoyl)thiophene has 0 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 2-(4-Nitrobenzoyl)thiophene?
The CAS number of 2-(4-Nitrobenzoyl)thiophene is 34918-79-1.
What is the molecular formula of 2-(4-Nitrobenzoyl)thiophene?
The molecular formula of 2-(4-Nitrobenzoyl)thiophene is C11H7NO3S.
What is the molecular weight of 2-(4-Nitrobenzoyl)thiophene?
The molecular weight of 2-(4-Nitrobenzoyl)thiophene is 233.01 g/mol.
Where can I buy 2-(4-Nitrobenzoyl)thiophene?
You can request a quote for 2-(4-Nitrobenzoyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitrobenzoyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrobenzoyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.