2,5-Dichloro-3-nitrothiophene
TL;DR: 2,5-Dichloro-3-nitrothiophene (CAS 37105-12-7) is a chemical compound with molecular formula C4HCl2NO2S and molecular weight 196.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-3-nitrothiophene
Also Known As: 2,5-dichloro-3-nitrothiophene, C4HCl2NO2S, Thiophene, 2,5-dichloro-3-nitro-, 2,5-dichloro-3-nitro-thiophene, 2,5-bis(chloranyl)-3-nitro-thiophene
| Molecular Formula | C4HCl2NO2S |
|---|---|
| Molecular Weight | 196.91 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 74.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.9105 |
| Heavy Atoms | 10 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 37105-12-7 |
|---|---|
| SMILES | C1=C(SC(=C1[N+](=O)[O-])Cl)Cl |
| InChIKey | BFQBMQKCYWOSEN-UHFFFAOYSA-N |
Product Overview
2,5-Dichloro-3-nitrothiophene (CAS 37105-12-7), with molecular formula C4HCl2NO2S and molecular weight 196.91 g/mol. IUPAC: 2,5-dichloro-3-nitrothiophene.
Chemical Property Profile of 2,5-Dichloro-3-nitrothiophene
Property Insights of 2,5-Dichloro-3-nitrothiophene
The XLogP value of 3.4 indicates that 2,5-Dichloro-3-nitrothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dichloro-3-nitrothiophene. Following Lipinski's Rule of Five, 2,5-Dichloro-3-nitrothiophene 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 2,5-Dichloro-3-nitrothiophene?
The CAS number of 2,5-Dichloro-3-nitrothiophene is 37105-12-7.
What is the molecular formula of 2,5-Dichloro-3-nitrothiophene?
The molecular formula of 2,5-Dichloro-3-nitrothiophene is C4HCl2NO2S.
What is the molecular weight of 2,5-Dichloro-3-nitrothiophene?
The molecular weight of 2,5-Dichloro-3-nitrothiophene is 196.91 g/mol.
Where can I buy 2,5-Dichloro-3-nitrothiophene?
You can request a quote for 2,5-Dichloro-3-nitrothiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-3-nitrothiophene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-3-nitrothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.