![Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester structure](/static/products/1219/121-94-8.webp)
Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester
TL;DR: Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester (CAS 121-94-8) is a chemical compound with molecular formula C14H18N2O7S and molecular weight 358.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(1,4-diethoxy-1,4-dioxobutan-2-ylidene)hydrazinyl]benzenesulfonic acid
Also Known As: 1,4-diethyl 2-[(4-sulphophenyl)hydrazono]succinate, Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester, Oxalacetic acid, diethyl ester, (p-sulfophenyl)hydrazone, 1,4-Diethyl 2-[2-(4-sulfophenyl)hydrazinylidene]butanedioate, 4-[2-(1,4-diethoxy-1,4-dioxobutan-2-ylidene)hydrazinyl]benzenesulfonic acid
| Molecular Formula | C14H18N2O7S |
|---|---|
| Molecular Weight | 358.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 358.08347 |
| Heavy Atoms | 24 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 121-94-8 |
|---|---|
| SMILES | CCOC(=O)CC(=NNC1=CC=C(C=C1)S(=O)(=O)O)C(=O)OCC |
| InChIKey | XNVPROHJLYURRG-UHFFFAOYSA-N |
Product Overview
Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester (CAS 121-94-8), with molecular formula C14H18N2O7S and molecular weight 358.08 g/mol. IUPAC: 4-[2-(1,4-diethoxy-1,4-dioxobutan-2-ylidene)hydrazinyl]benzenesulfonic acid.
Chemical Property Profile of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester
Property Insights of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester. The TPSA of 140.0 Ų indicates high polarity, suggesting Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester has 2 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 Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester?
The CAS number of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester is 121-94-8.
What is the molecular formula of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester?
The molecular formula of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester is C14H18N2O7S.
What is the molecular weight of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester?
The molecular weight of Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester is 358.08 g/mol.
Where can I buy Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester?
You can request a quote for Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, [(4-sulfophenyl)hydrazono]-, 1,4-diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.