Thiophene, 2-nitro-
TL;DR: Thiophene, 2-nitro- (CAS 609-40-5) is a chemical compound with molecular formula C4H3NO2S and molecular weight 128.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrothiophene
Also Known As: 2-NITROTHIOPHENE, Thiophene, 2-nitro-, 2-nitro-thiophene, 2-Nitro thiophene, nitrothiophene
| Molecular Formula | C4H3NO2S |
|---|---|
| Molecular Weight | 128.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 74.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.98845 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 609-40-5 |
|---|---|
| SMILES | C1=CSC(=C1)[N+](=O)[O-] |
| InChIKey | JIZRGGUCOQKGQD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiophene, 2-nitro- (CAS 609-40-5), with molecular formula C4H3NO2S and molecular weight 128.99 g/mol. IUPAC: 2-nitrothiophene.
Chemical Property Profile of Thiophene, 2-nitro-
Property Insights of Thiophene, 2-nitro-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophene, 2-nitro-. The TPSA of 74.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiophene, 2-nitro-. Following Lipinski's Rule of Five, Thiophene, 2-nitro- 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 Thiophene, 2-nitro-?
The CAS number of Thiophene, 2-nitro- is 609-40-5.
What is the molecular formula of Thiophene, 2-nitro-?
The molecular formula of Thiophene, 2-nitro- is C4H3NO2S.
What is the molecular weight of Thiophene, 2-nitro-?
The molecular weight of Thiophene, 2-nitro- is 128.99 g/mol.
Where can I buy Thiophene, 2-nitro-?
You can request a quote for Thiophene, 2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene, 2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, 2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.