4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸
TL;DR: 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 (CAS 119-72-2) is a chemical compound with molecular formula C14H12N2O8S2 and molecular weight 400.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸
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
| Molecular Formula | C14H12N2O8S2 |
|---|---|
| Molecular Weight | 400.00 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.0035 |
| Heavy Atoms | 26 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 119-72-2 |
|---|---|
| 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 |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 (CAS 119-72-2), with molecular formula C14H12N2O8S2 and molecular weight 400.00 g/mol. IUPAC: 5-amino-2-[2-(4-nitro-2-sulfophenyl)ethenyl]benzenesulfonic acid.
Chemical Property Profile of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸
Property Insights of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸. The TPSA of 197.0 Ų indicates high polarity, suggesting 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 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
Frequently Asked Questions
What is the CAS number of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸?
The CAS number of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 is 119-72-2.
What is the molecular formula of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸?
The molecular formula of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 is C14H12N2O8S2.
What is the molecular weight of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸?
The molecular weight of 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 is 400.00 g/mol.
Where can I buy 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸?
You can request a quote for 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基-4'-氨基-二苯乙烯-2,2'-二磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.