![[(2-Nitrophenyl)sulfonyl]acetic acid structure](/static/products/2748/27489-27-6.webp)
[(2-Nitrophenyl)sulfonyl]acetic acid
TL;DR: [(2-Nitrophenyl)sulfonyl]acetic acid (CAS 27489-27-6) is a chemical compound with molecular formula C8H7NO6S and molecular weight 245.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrophenyl)sulfonylacetic acid
Also Known As: [(2-Nitrophenyl)sulfonyl]acetic acid|2-(2-nitrophenyl)sulfonylacetic acid|2-(2-nitrobenzenesulfonyl)acetic acid|2-[(2-nitrophenyl)sulfonyl]acetic acid|(2-nitrobenzenesulfonyl)acetic acid|SDCCGMLS-0065635.P001|2-((2-Nitrophenyl)sulfonyl)aceticacid|(2-Nitrobenzene-1-sulfonyl)acetic acid|2-((2-Nitrophenyl)sulfonyl)acetic acid|2-[(2-nitrobenzene)sulfonyl]acetic acid|Acetic acid, [(2-nitrophenyl)sulfonyl]-|SR-01000643876-1|F1905-0001
| Molecular Formula | C8H7NO6S |
|---|---|
| Molecular Weight | 245.00 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.9994 |
| Heavy Atoms | 16 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 27489-27-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)CC(=O)O |
| InChIKey | MWXQLKQDSAWKFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[(2-Nitrophenyl)sulfonyl]acetic acid (CAS 27489-27-6), with molecular formula C8H7NO6S and molecular weight 245.00 g/mol. IUPAC: 2-(2-nitrophenyl)sulfonylacetic acid.
Chemical Property Profile of [(2-Nitrophenyl)sulfonyl]acetic acid
Property Insights of [(2-Nitrophenyl)sulfonyl]acetic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Nitrophenyl)sulfonyl]acetic acid. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Nitrophenyl)sulfonyl]acetic acid. Following Lipinski's Rule of Five, [(2-Nitrophenyl)sulfonyl]acetic acid has 1 hydrogen bond donor(s) and 6 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-Nitrophenyl)sulfonyl]acetic acid?
The CAS number of [(2-Nitrophenyl)sulfonyl]acetic acid is 27489-27-6.
What is the molecular formula of [(2-Nitrophenyl)sulfonyl]acetic acid?
The molecular formula of [(2-Nitrophenyl)sulfonyl]acetic acid is C8H7NO6S.
What is the molecular weight of [(2-Nitrophenyl)sulfonyl]acetic acid?
The molecular weight of [(2-Nitrophenyl)sulfonyl]acetic acid is 245.00 g/mol.
Where can I buy [(2-Nitrophenyl)sulfonyl]acetic acid?
You can request a quote for [(2-Nitrophenyl)sulfonyl]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-Nitrophenyl)sulfonyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(2-Nitrophenyl)sulfonyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.