4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid
TL;DR: 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid (CAS 119-72-2) is a chemical compound with molecular formula C14H12N2O8S2 and molecular weight 400.0035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-2-[2-(4-nitro-2-sulfophenyl)ethenyl]benzenesulfonic acid
Also Known As: 4-Nitro-4'-aminostilbene-2,2'-disulfonic acid, 4-Amino-4'-nitro-2,2'-stilbenedisulfonic acid, 4-amino-4'-nitrostilbene-2,2'-disulphonic acid, 0-14-00-00798 (Beilstein Handbook Reference), 4-nitro-4'-amino-stilbene-2,2'-disulphonic acid
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H12N2O8S2 |
| Molecular Weight | 400.0035 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 197.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.0035 Da |
| Heavy Atoms | 26 |
| Complexity | 747.0 |
| SMILES | C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O |
| InChIKey | GHBWBMDGBCKAQU-UHFFFAOYSA-N |
Chemical Property Profile of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid
Property Insights of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid. The TPSA of 197.0 Ų indicates high polarity, suggesting 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid?
The CAS number of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid is 119-72-2.
What is the molecular formula of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid?
The molecular formula of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid is C14H12N2O8S2.
What is the molecular weight of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid?
The molecular weight of 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid is 400.0035 g/mol.
Where can I buy 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid?
You can request a quote for 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid?
Yes, CoreyChem provides custom synthesis services for 4-Nitro-4'-amino-stilbene-2,2'-disulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.