![2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid structure](/static/products/7715/77151-59-8.webp)
2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid
TL;DR: 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid (CAS 77151-59-8) is a chemical compound with molecular formula C6H5NO4S2 and molecular weight 218.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrothiophen-3-yl)sulfanylacetic acid
Also Known As: 2-[(2-nitrothiophen-3-yl)sulfanyl]acetic acid, 2-(2-nitrothiophen-3-yl)sulfanylacetic Acid, [(2-nitrothiophen-3-yl)sulfanyl]acetic acid, 2-[(2-nitrothiophen-3-yl)sulfanyl]aceticacid, 2-((2-NITROTHIOPHEN-3-YL)THIO)ACETIC ACID
| Molecular Formula | C6H5NO4S2 |
|---|---|
| Molecular Weight | 218.97 g/mol |
| LogP | 1.833 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.966 |
| Heavy Atoms | 13 |
| Complexity | 335.13016 |
Chemical Identifiers
| CAS Number | 77151-59-8 |
|---|---|
| SMILES | C1=CSC(=C1SCC(=O)O)[N+](=O)[O-] |
Product Overview
2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid (CAS 77151-59-8), with molecular formula C6H5NO4S2 and molecular weight 218.97 g/mol. IUPAC: 2-(2-nitrothiophen-3-yl)sulfanylacetic acid.
Chemical Property Profile of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid
Property Insights of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid
The XLogP value of 1.833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid. Following Lipinski's Rule of Five, 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid has 1 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 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid?
The CAS number of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid is 77151-59-8.
What is the molecular formula of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid?
The molecular formula of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid is C6H5NO4S2.
What is the molecular weight of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid?
The molecular weight of 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid is 218.97 g/mol.
Where can I buy 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid?
You can request a quote for 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Nitrothiophen-3-yl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.