4-Nitrothiophene-2-carbaldehyde
TL;DR: 4-Nitrothiophene-2-carbaldehyde (CAS 57500-53-5) is a chemical compound with molecular formula C5H3NO3S and molecular weight 156.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitrothiophene-2-carbaldehyde
Also Known As: 4-nitrothiophene-2-carbaldehyde, 2-Thiophenecarboxaldehyde, 4-nitro-, 4-nitrothiophene-2-carboxaldehyde, 4-nitro-2-thiophenecarboxaldehyde, 4-Nitro-thiophene-2-carbaldehyde
| Molecular Formula | C5H3NO3S |
|---|---|
| Molecular Weight | 156.98 g/mol |
| LogP | 1.4688 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.98337 |
| Heavy Atoms | 10 |
| Complexity | 267.6117 |
Chemical Identifiers
| CAS Number | 57500-53-5 |
|---|---|
| SMILES | C1=C(SC=C1[N+](=O)[O-])C=O |
Product Overview
4-Nitrothiophene-2-carbaldehyde (CAS 57500-53-5), with molecular formula C5H3NO3S and molecular weight 156.98 g/mol. IUPAC: 4-nitrothiophene-2-carbaldehyde.
Chemical Property Profile of 4-Nitrothiophene-2-carbaldehyde
Property Insights of 4-Nitrothiophene-2-carbaldehyde
The XLogP value of 1.4688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrothiophene-2-carbaldehyde. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrothiophene-2-carbaldehyde. Following Lipinski's Rule of Five, 4-Nitrothiophene-2-carbaldehyde 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 4-Nitrothiophene-2-carbaldehyde?
The CAS number of 4-Nitrothiophene-2-carbaldehyde is 57500-53-5.
What is the molecular formula of 4-Nitrothiophene-2-carbaldehyde?
The molecular formula of 4-Nitrothiophene-2-carbaldehyde is C5H3NO3S.
What is the molecular weight of 4-Nitrothiophene-2-carbaldehyde?
The molecular weight of 4-Nitrothiophene-2-carbaldehyde is 156.98 g/mol.
Where can I buy 4-Nitrothiophene-2-carbaldehyde?
You can request a quote for 4-Nitrothiophene-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrothiophene-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrothiophene-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.